SCHEMBL16320357

SCHEMBL16320357

Cc1cc(Nc2cc(-c3cccs3)n[nH]2)nc(Nc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)nc2)n1

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
BRAF P15056 8/20 0.43
MAPK14 Q16539 1/20 0.43
RAF1 P04049 2/20 0.42
KDR P35968 6/20 0.41
TEK Q02763 1/20 0.41
CDK8 P49336 5/20 0.41
CCNC P24863 1/20 0.41
TRPV1 Q8NER1 1/20 0.40
AURKB Q96GD4 1/20 0.40
PDGFRB P09619 1/20 0.39
FLT3 P36888 1/20 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
SCHEMBL16320370 0.92 BRAF (0.37) BRAFMAPK14RAF1KDRTEK
SCHEMBL16319836 0.89 BRAF (0.44) BRAFMAPK14RAF1KDRTRPV1
SCHEMBL16320371 0.88 BRAF (0.33) BRAFMAPK14RAF1KDRTEK
SCHEMBL16319588 0.88 BRAF (0.41) BRAFMAPK14RAF1KDRTEK
SCHEMBL16319899 0.87 TEK (0.46) BRAFMAPK14RAF1KDRTEK
SCHEMBL16320206 0.86 BRAF (0.44) BRAFMAPK14RAF1KDRTEK
SCHEMBL16319852 0.86 TEK (0.46) BRAFMAPK14RAF1KDRTEK
SCHEMBL16319897 0.85 IGF1R (0.45) BRAFMAPK14KDRTEKCDK8
SCHEMBL16320232 0.85 TEK (0.45) BRAFMAPK14RAF1KDRTEK
SCHEMBL16320016 0.85 TEK (0.45) BRAFMAPK14RAF1KDRTEK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9221798-B2 4-substituted-(3-substituted-1H-pyrazole-5-amino)-pyrimidine derivatives having activity of inhibiting protein kinase and use thereof Zhejian Hisun Pharmaceutical Co., Ltd. (CN) 2015-12-29 US disclosed
US-20140378488-A1 4-SUBSTITUTED-(3-SUBSTITUTED-1H-PYRAZOLE-5-AMINO)-PYRIMIDINE DERIVATIVES HAVING ACTIVITY OF INHIBITING PROTEIN KINASE AND USE THEREOF ZHEJIANG HISUN PHARMACEUTICAL CO., LTD. (CN) 2014-12-25 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 (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-20140378488-A1 4-SUBSTITUTED-(3-SUBSTITUTED-1H-PYRAZOLE-5-AMINO)-PYRIMIDINE DERIVATIVES HAVING ACTIVITY OF INHIBITING PROTEIN KINASE AND USE THEREOF MAP4K2, MAP4K1, MAP4K3 BRAF 84/4885MAPK14 114/4885RAF1 53/4885

“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.