SCHEMBL5338097

SCHEMBL5338097

Cc1cccc(NC(=O)Nc2nc(-c3ccncc3)sc2Br)n1

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 12/20 0.55
GBA1 P04062 9/20 0.51
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
POLB P06746 1/20 0.51
NPC1 O15118 8/20 0.48
SMN1; SMN2 Q16637 5/20 0.47
MAPT P10636 4/20 0.47
TP53 P04637 3/20 0.47
GRM5 P41594 2/20 0.46
CDK5 Q00535 3/20 0.45
CDK5R1 Q15078 3/20 0.45
TSHR P16473 1/20 0.44
ALDH1A1 P00352 1/20 0.43
LMNA P02545 1/20 0.43

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
SCHEMBL5339268 0.82 CDK5 (0.40) RAB9APOLBMAPTCDK5CDK5R1
SCHEMBL7059452 0.82 RAB9A (0.52) RAB9AGBA1MEN1KMT2APOLB
Hydrochloric Acid SCHEMBL5354413 0.81 CDK5 (0.40) RAB9APOLBMAPTCDK5CDK5R1
SCHEMBL6650844 0.80 CDK5 (0.38) POLBMAPTCDK5CDK5R1ALDH1A1
SCHEMBL5345140 0.80 CDK5 (0.69) RAB9AGBA1MEN1KMT2APOLB
SCHEMBL14353530 0.74 RAB9A (1.00) RAB9AGBA1MEN1KMT2APOLB
SCHEMBL6630826 0.72 RAB9A (0.71) RAB9AGBA1MEN1KMT2APOLB
SCHEMBL5338101 0.72 RAB9A (0.53) RAB9AGBA1MEN1KMT2APOLB
SCHEMBL27800597 0.68 BLM (0.57) RAB9AGBA1MEN1KMT2ANPC1
SCHEMBL1142765 0.66 RAB9A (1.00) RAB9AGBA1MEN1KMT2APOLB

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 13 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7196104-B2 Thiazolyl urea compounds and methods of uses AMGEN, INC. (US) 2007-03-27 US disclosed
US-7196104-B2 Thiazolyl urea compounds and methods of uses AMGEN, INC. (US) 2007-03-27 US disclosed
US-7196104-B2 Thiazolyl urea compounds and methods of uses AMGEN, INC. (US) 2007-03-27 US disclosed
EP-1619184-A2 Urea compounds as kinase inhibitors Amgen, Inc. (US) 2006-01-25 EP disclosed
EP-1483263-A1 THIAZOLYL UREA COMPOUNDS FOR THE TREATMENT OF CANCER Amgen Inc. (US) 2004-12-08 EP disclosed
US-20040044044-A1 Thiazolyl urea compounds and methods of uses AMGEN INC. 2004-03-04 US disclosed
US-20040039029-A1 Thiazolyl urea compounds and methods of uses AMGEN INC. 2004-02-26 US disclosed
US-6645990-B2 For prophylaxis and therapy of diseases, such as cell proliferation or apoptosis mediated diseases AMGEN INC. 2003-11-11 US disclosed
WO-2003070727-A1 THIAZOLYL UREA COMPOUNDS FOR THE TREATMENT OF CANCER AMGEN INC. (US) 2003-08-28 WO disclosed
EP-1309589-A2 UREA COMPOUNDS AND METHODS OF USES Amgen Inc. (US) 2003-05-14 EP disclosed
US-20020193405-A1 Thiazolyl urea compounds and methods of uses AMGEN INC. 2002-12-19 US disclosed
US-20020173507-A1 Urea compounds and methods of uses AMGEN INC. 2002-11-21 US disclosed
WO-2002014311-A2 UREA COMPOUNDS AND METHODS OF USES AMGEN INC. (US) 2002-02-21 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 (4 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-20020193405-A1 Thiazolyl urea compounds and methods of uses SLC14A1, UMPS, BAX RAB9A 3370/4885GBA1 833/4885MEN1 1181/4885
US-20020173507-A1 Urea compounds and methods of uses SLC14A1, UMPS, BAX RAB9A 2958/4885GBA1 494/4885MEN1 1521/4885
US-20040039029-A1 Thiazolyl urea compounds and methods of uses SLC14A1, UMPS, BAX RAB9A 3370/4885GBA1 833/4885MEN1 1181/4885
US-20040044044-A1 Thiazolyl urea compounds and methods of uses SLC14A1, UMPS, BAX RAB9A 3370/4885GBA1 833/4885MEN1 1181/4885

“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.