SCHEMBL3427476

SCHEMBL3427476

COC(=O)c1cc(Br)c(F)c(F)c1Nc1ccccc1Cl

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 1/20 0.46
CSF1R P07333 3/20 0.44
ALOX5 P09917 1/20 0.42
MAPT P10636 3/20 0.40
SOS1 Q07889 1/20 0.40
ALOX15 P16050 1/20 0.40
POLB P06746 2/20 0.39
ATM Q13315 2/20 0.39
KDM4E B2RXH2 2/20 0.39
NPC1 O15118 1/20 0.38
CASP3 P42574 1/20 0.38
SENP8 Q96LD8 1/20 0.38
SENP7 Q9BQF6 1/20 0.38
SENP6 Q9GZR1 1/20 0.38
CLCN2 P51788 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2D6 P10635 1/20 0.38
TSHR P16473 1/20 0.38
CYP2C19 P33261 1/20 0.38
CXCR2 P25025 1/20 0.38

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
SCHEMBL1341502 0.87 KDM4E (0.47) PTGS2CSF1RMAPTSOS1ALOX15
SCHEMBL3426199 0.86 CSF1R (0.44) PTGS2CSF1RMAPTSOS1ATM
SCHEMBL13841942 0.86 KMT2A (0.51) PTGS2CSF1RMAPTSOS1ALOX15
SCHEMBL3429050 0.86 MAP2K1 (0.47) PTGS2MAPTCLCN2CYP1A2CYP2C19
SCHEMBL19367457 0.85 PTGS2 (0.46) PTGS2CSF1RALOX5MAPTALOX15
SCHEMBL14428417 0.85 PTGS2 (0.46) PTGS2CSF1RALOX5MAPTALOX15
SCHEMBL3426662 0.85 PTGS2 (0.46) PTGS2CSF1RALOX5MAPTALOX15
SCHEMBL3969081 0.82 SRC (0.46) PTGS2CSF1RALOX5MAPTALOX15
SCHEMBL1077964 0.81 PTGS2 (0.45) PTGS2CSF1RALOX5MAPTALOX15
SCHEMBL15129388 0.81 PTGS2 (0.44) PTGS2CSF1RALOX5MAPTALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9937158-B2 Benzoheterocyclic compounds and use thereof SHANGHAI KECHOW PHARMA, INC. (CN) 2018-04-10 US disclosed
EP-2804855-B1 BENZOHETEROCYCLIC COMPOUNDS AND USE THEREOF SHANGHAI KECHOW PHARMA INC (CN) 2017-09-20 EP disclosed
EP-2804855-B1 BENZOHETEROCYCLIC COMPOUNDS AND USE THEREOF SHANGHAI KECHOW PHARMA INC (CN) 2017-09-20 EP disclosed
US-20160235721-A1 BENZOHETEROCYCLIC COMPOUNDS AND USE THEREOF TIANJIN BINJIANG PHARMA, INC. (CN) 2016-08-18 US disclosed
US-20160235721-A1 BENZOHETEROCYCLIC COMPOUNDS AND USE THEREOF TIANJIN BINJIANG PHARMA, INC. (CN) 2016-08-18 US disclosed
US-9290468-B2 Benzoheterocyclic compounds and use thereof SHANGHAI KECHOW PHARMA, INC. (CN) 2016-03-22 US disclosed
US-9290468-B2 Benzoheterocyclic compounds and use thereof SHANGHAI KECHOW PHARMA, INC. (CN) 2016-03-22 US disclosed
US-20140371278-A1 BENZOHETEROCYCLIC COMPOUNDS AND USE THEREOF TIANJIN BINJIANG PHARMA, INC. (CN) 2014-12-18 US disclosed
US-20140371278-A1 BENZOHETEROCYCLIC COMPOUNDS AND USE THEREOF TIANJIN BINJIANG PHARMA, INC. (CN) 2014-12-18 US disclosed
EP-2804855-A1 BENZOHETEROCYCLIC COMPOUNDS AND USE THEREOF Tianjin Binjiang Pharma, Inc. (CN) 2014-11-26 EP disclosed
US-20060189649-A1 Heterocyclic inhibitors of MEK and methods of use thereof ARRAY BIOPHARMA INC. (US) 2006-08-24 US disclosed
US-20060189808-A1 Heterocyclic inhibitors of MEK and methods of use thereof ARRAY BIOPHARMA INC. (US) 2006-08-24 US disclosed
EP-1689233-A2 BICYCLIC INHIBITORS OF MEK AND METHODS OF USE THEREOF Array Biopharma, Inc. (US) 2006-08-16 EP disclosed
EP-1673339-A2 HETEROCYCLIC INHIBITORS OF MEK AND METHODS OF USE THEREOF Array Biopharma, Inc. (US) 2006-06-28 EP disclosed
US-20060030610-A1 Method of treating inflammatory diseases ARRAY BIOPHARMA INC. 2006-02-09 US disclosed
US-20050130976-A1 Bicyclic inhibitors of MEK and methods of use thereof ARRAY BIOPHARMA INC. 2005-06-16 US disclosed
WO-2005051302-A2 BICYCLIC INHIBITORS OF MEK AND METHODS OF USE THEREOF ARRAY BIOPHARMA INC. (US) 2005-06-09 WO disclosed
WO-2005023759-A2 HETEROCYCLIC INHIBITORS OF MEK AND METHODS OF USE THEREOF ARRAY BIOPHARMA INC. (US) 2005-03-17 WO disclosed
US-20050054701-A1 Heterocyclic inhibitors of MEK and methods of use thereof ARRAY BIOPHARMA INC. 2005-03-10 US disclosed
US-20050049419-A1 Heterocyclic inhibitors of MEK and methods of use thereof ARRAY BIOPHARMA, INC. 2005-03-03 US 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 (8 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-20060189649-A1 Heterocyclic inhibitors of MEK and methods of use thereof NRAS, BRAF, RAF1 PTGS2 1213/4885CSF1R 1571/4885ALOX5 1330/4885
US-20140371278-A1 BENZOHETEROCYCLIC COMPOUNDS AND USE THEREOF CDK2, CDK1, MAP3K1 PTGS2 218/4885CSF1R 1686/4885ALOX5 1062/4885
US-20050049419-A1 Heterocyclic inhibitors of MEK and methods of use thereof NRAS, BRAF, RAF1 PTGS2 1115/4885CSF1R 1633/4885ALOX5 1299/4885
US-20060189808-A1 Heterocyclic inhibitors of MEK and methods of use thereof NRAS, BRAF, RAF1 PTGS2 1276/4885CSF1R 1664/4885ALOX5 1487/4885
US-20050054701-A1 Heterocyclic inhibitors of MEK and methods of use thereof NRAS, BRAF, RAF1 PTGS2 1115/4885CSF1R 1633/4885ALOX5 1299/4885
US-20060030610-A1 Method of treating inflammatory diseases TNF, MPO, FABP2 PTGS2 12/4885CSF1R 1311/4885ALOX5 48/4885
US-20160235721-A1 BENZOHETEROCYCLIC COMPOUNDS AND USE THEREOF CDK2, MAPK1, BDKRB1 PTGS2 257/4885CSF1R 1661/4885ALOX5 1098/4885
US-20050130976-A1 Bicyclic inhibitors of MEK and methods of use thereof NRAS, BRAF, RAF1 PTGS2 1226/4885CSF1R 1736/4885ALOX5 1424/4885

“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.