SCHEMBL73436

SCHEMBL73436

O=[N+]([O-])c1ccc(-c2cn3c(n2)sc2ccc(O)cc23)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F2RL3 Q96RI0 1/20 0.46
MBD2 Q9UBB5 1/20 0.46
FLT3 P36888 2/20 0.45
RAD51 Q06609 1/20 0.44
CA12 O43570 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
CA9 Q16790 1/20 0.43
ADORA2A P29274 1/20 0.42
MAOB P27338 1/20 0.42
MAPT P10636 4/20 0.39
LMNA P02545 3/20 0.39
RXFP1 Q9HBX9 2/20 0.39
TP53 P04637 2/20 0.39
ESR1 P03372 1/20 0.39
ESR2 Q92731 1/20 0.39
RAB9A P51151 3/20 0.39
KMT2A Q03164 2/20 0.39
NPC1 O15118 1/20 0.39
TDP1 Q9NUW8 2/20 0.39

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL73435 0.91 FLT3 (0.52) F2RL3MBD2FLT3RAD51MAOB
SCHEMBL11013464 0.86 FLT3 (0.49) FLT3ADORA2AMAPTLMNARXFP1
SCHEMBL28419499 0.86 FLT3 (0.47) F2RL3MBD2FLT3MAPTLMNA
SCHEMBL74474 0.84 F2RL3 (0.42) F2RL3MBD2FLT3CA12CA1
SCHEMBL774164 0.83 TP53 (0.57) F2RL3MBD2ADORA2AMAPTLMNA
SCHEMBL73916 0.83 MBD2 (0.58) F2RL3MBD2FLT3CA12CA1
SCHEMBL14875121 0.83 F2RL3 (0.46) F2RL3MBD2MAPTLMNARXFP1
Bromide SCHEMBL3863602 0.83 LMNA (0.50) F2RL3MBD2MAPTLMNATP53
SCHEMBL72902 0.82 AKR1C3 (0.47) F2RL3MBD2CA12CA1CA2
SCHEMBL20303359 0.82 FLT3 (0.46) FLT3RAD51ADORA2AMAPTLMNA

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 40 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3150612-A1 PROCESS FOR THE PREPARATION OF IMIDAZO[2,1-B][1,3]BENZOTHIAZOLE DERIVATIVES Ambit Biosciences Corporation (US) 2017-04-05 EP claimed
EP-2496584-B1 PROCESS FOR THE PREPARATION OF IMIDAZO[2,1-B][1,3]BENZOTHIAZOLE DERIVATIVES AMBIT BIOSCIENCES CORP (US) 2016-09-21 EP claimed
US-9284332-B2 Process for the preparation of imidazo[2,1-B][1,3]benzothiazole derivatives AMBIT BIOSCIENCES CORPORATION (US) 2016-03-15 US claimed
US-20130005966-A1 PROCESS FOR THE PREPARATION OF IMIDAZO[2,1-B][1,3]BENZOTHIAZOLE DERIVATIVES AMBIT BIOSCIENCES CORP. (US) 2013-01-03 US claimed
EP-2496584-A1 PROCESS FOR THE PREPARATION OF IMIDAZO[2,1-B][1,3]BENZOTHIAZOLE DERIVATIVES Ambit Biosciences Corp. (US) 2012-09-12 EP claimed
WO-2011056939-A1 PROCESS FOR THE PREPARATION OF IMIDAZO[2,1-B][1,3]BENZOTHIAZOLE DERIVATIVES AMBIT BIOSCIENCES CORP. (US) 2011-05-12 WO claimed
US-10806737-B2 Compounds and methods for the targeted degradation of fetal liver kinase polypeptides ARVINAS OPERATIONS, INC. (US) 2020-10-20 US disclosed
EP-3559006-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF FETAL LIVER KINASE POLYPEPTIDES Arvinas Operations, Inc. (US) 2019-10-30 EP disclosed
US-20180256586-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF FETAL LIVER KINASE POLYPEPTIDES ARVINAS OPERATIONS, INC. 2018-09-13 US disclosed
WO-2018118598-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF FETAL LIVER KINASE POLYPEPTIDES Arvinas, Inc. (US) 2018-06-28 WO disclosed
US-20170348320-A1 IMIDAZOLOTHIAZOLE COMPOUNDS FOR THE TREATMENT OF DISEASE AMBIT BIOSCIENCES CORP (US) 2017-12-07 US disclosed
EP-3150612-A1 PROCESS FOR THE PREPARATION OF IMIDAZO[2,1-B][1,3]BENZOTHIAZOLE DERIVATIVES Ambit Biosciences Corporation (US) 2017-04-05 EP disclosed
US-9585892-B2 Solid forms comprising N-(5-tert-butyl-isoxazol-3-yl)-N′-{4-[7-(2-morpholin-4-yl-ethoxy)imidazo[2,1-b][1,3]benzothiazol-2-yl]phenyl}urea, compositions thereof, and uses therewith AMBIT BIOSCIENCES (US) 2017-03-07 US disclosed
US-7820657-B2 receptor kinase inhibitors such as 3-(2-{4-[3-(5-tert-Butyl-isoxazol-3-yl)-ureido]-phenyl}-benzo[d]imidazo[2,1-b]thiazol-7-yl)-N-(2-morpholin-4-yl-ethyl)-propionamide; flk inhibitors AMBIT BIOSCIENCES CORPORATION (US) 2010-10-26 US disclosed
EP-2201018-A2 SOLID FORMS COMPRISING N-(5-TERT-BUTYL-ISOXAZOL-3-YL)-N'-{4-Ý7-(2-MORPHOLIN-4-YL-ETHOXY)IMIDAZOÝ2,1-B¨Ý1,3¨BENZOTHIAZOL-2-YL¨PHENYL}UREA, COMPOSITIONS THEREOF, AND USES THEREWITH Ambit Biosciences Corporation (US) 2010-06-30 EP disclosed
US-20090131426-A1 SOLID FORMS COMPRISING N-(5-TERT-BUTYL-ISOXAZOL-3-YL)-N'-UREA, COMPOSITIONS THEREOF, AND USES THEREWITH AMBIT BIOSCIENCES 2009-05-21 US disclosed
WO-2009038757-A2 SOLID FORMS COMPRISING N-(5-TERT-BUTYL-ISOXAZOL-3-YL)-N'-{4-[7-(2-MORPHOLIN-4-YL-ETHOXY)IMIDAZO[2,1-B][1,3]BENZOTHIAZOL-2-YL]PHENYL}UREA, COMPOSITIONS THEREOF, AND USES THEREWITH AMBIT BIOSCIENCES CORPORATION (US) 2009-03-26 WO disclosed
EP-2001892-A2 IMIDAZOLOTHIAZOLE COMPOUNDS FOR THE TREATMENT OF DISEASE Ambit Biosciences Corporation (US) 2008-12-17 EP disclosed
US-20070232604-A1 receptor kinase inhibitors such as 3-(2-{4-[3-(5-tert-Butyl-isoxazol-3-yl)-ureido]-phenyl}-benzo[d]imidazo[2,1-b]thiazol-7-yl)-N-(2-morpholin-4-yl-ethyl)-propionamide; flk inhibitors AMBIT BIOSCIENCES CORPORATION 2007-10-04 US disclosed
WO-2007109120-A2 IMIDAZOLOTHIAZOLE COMPOUNDS FOR THE TREATMENT OF DISEASE AMBIT BIOSCIENCES CORPORATION (US) 2007-09-27 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (6 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20180256586-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF FETAL LIVER KINASE POLYPEPTIDES MDM2, CRBN, FLT3 F2RL3 2150/4885MBD2 3294/4885FLT3 3/4885
US-20090131426-A1 SOLID FORMS COMPRISING N-(5-TERT-BUTYL-ISOXAZOL-3-YL)-N'-UREA, COMPOSITIONS THEREOF, AND USES THEREWITH OAT, TERT, TPMT F2RL3 4753/4885MBD2 3792/4885FLT3 797/4885
US-20170348320-A1 IMIDAZOLOTHIAZOLE COMPOUNDS FOR THE TREATMENT OF DISEASE GRK2, GRK4, GRK3 F2RL3 1215/4885MBD2 1996/4885FLT3 210/4885
US-20130005966-A1 PROCESS FOR THE PREPARATION OF IMIDAZO[2,1-B][1,3]BENZOTHIAZOLE DERIVATIVES FLT4, FLT1, FLT3 F2RL3 1605/4885MBD2 1005/4885FLT3 3/4885
US-20070232604-A1 receptor kinase inhibitors such as 3-(2-{4-[3-(5-tert-Butyl-isoxazol-3-yl)-ureido]-phenyl}-benzo[d]imidazo[2,1-b]thiazol-7-yl)-N-(2-morpholin-4-yl-ethyl)-propionamide; flk inhibitors GRK2, GRK3, BLK F2RL3 414/4885MBD2 1528/4885FLT3 128/4885
US-10806737-B2 Compounds and methods for the targeted degradation of fetal liver kinase polypeptides MDM2, CRBN, FLT3 F2RL3 2150/4885MBD2 3294/4885FLT3 3/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.