SCHEMBL4601137

SCHEMBL4601137

COCCNC(=O)c1ccc(Nc2ncc(Br)s2)cc1

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FPR2 P25090 1/20 0.49
BRAF P15056 9/20 0.48
HPGD P15428 1/20 0.47
RAF1 P04049 1/20 0.47
NPC1 O15118 2/20 0.46
HSP90AA1 P07900 1/20 0.46
ALDH1A1 P00352 1/20 0.46
NAMPT P43490 2/20 0.46
AURKA O14965 1/20 0.45
AURKB Q96GD4 1/20 0.45
RAB9A P51151 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
TP53 P04637 1/20 0.44

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
SCHEMBL4601463 0.86 FPR3 (0.45) FPR2HPGDALDH1A1RAB9ASMN1; SMN2
SCHEMBL4601318 0.86 BRAF (0.51) FPR2BRAFHPGDALDH1A1TP53
SCHEMBL4601937 0.85 HPGD (0.50) FPR2HPGDALDH1A1NAMPTRAB9A
SCHEMBL4599626 0.85 ALDH1A1 (0.49) FPR2BRAFHPGDALDH1A1NAMPT
SCHEMBL4601938 0.83 ALDH1A1 (0.39) FPR2HPGDALDH1A1RAB9ASMN1; SMN2
SCHEMBL4600687 0.83 ALDH1A1 (0.55) ALDH1A1NAMPTSMN1; SMN2
SCHEMBL14066779 0.81 RAB9A (0.46) NPC1RAB9ASMN1; SMN2
SCHEMBL4601056 0.81 NAMPT (0.46) FPR2NAMPT
SCHEMBL4600038 0.80 ALDH1A1 (0.52) FPR2BRAFHPGDALDH1A1NAMPT
SCHEMBL4601715 0.78 SMN1; SMN2 (0.55) HPGDNPC1ALDH1A1RAB9ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080227783-A1 5-Substituted Thiazol-2-Yl Amino Compounds and Compositions as Protein Kinase Inhibitors IRM LLC (BM) 2008-09-18 US claimed
EP-1912959-A2 5-SUBSTITUTED THIAZOL-2-YL AMINO COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2008-04-23 EP claimed
WO-2007016228-A2 5-SUBSTITUTED THIAZOL-2-YL AMINO COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2007-02-08 WO claimed
US-20080227783-A1 5-Substituted Thiazol-2-Yl Amino Compounds and Compositions as Protein Kinase Inhibitors IRM LLC (BM) 2008-09-18 US disclosed
US-20080227783-A1 5-Substituted Thiazol-2-Yl Amino Compounds and Compositions as Protein Kinase Inhibitors IRM LLC (BM) 2008-09-18 US disclosed
US-20080227783-A1 5-Substituted Thiazol-2-Yl Amino Compounds and Compositions as Protein Kinase Inhibitors IRM LLC (BM) 2008-09-18 US disclosed
EP-1912959-A2 5-SUBSTITUTED THIAZOL-2-YL AMINO COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2008-04-23 EP disclosed
WO-2007016228-A2 5-SUBSTITUTED THIAZOL-2-YL AMINO COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2007-02-08 WO disclosed
WO-2007016228-A2 5-SUBSTITUTED THIAZOL-2-YL AMINO COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2007-02-08 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 (1 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-20080227783-A1 5-Substituted Thiazol-2-Yl Amino Compounds and Compositions as Protein Kinase Inhibitors BMX, CDK1, CKS1B FPR2 3152/4885BRAF 93/4885HPGD 4343/4885

“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.