SCHEMBL2934476

SCHEMBL2934476

O=C(Nc1ccccc1)Nc1cnccc1CN1C(=O)N(c2ccc(OC(F)(F)F)cc2)C(=O)C12CC2

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
GCGR P47871 2/20 0.44
P2RY1 P47900 13/20 0.43
TRPV1 Q8NER1 1/20 0.41
PPARG P37231 1/20 0.40
PPARA Q07869 1/20 0.40
NAMPT P43490 1/20 0.39
IGF1R P08069 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
SCHEMBL2931754 0.91 TRPV1 (0.49) GCGRTRPV1PPARGPPARANAMPT
SCHEMBL2941101 0.90 GCGR (0.46) NPC1RAB9AGCGRP2RY1TRPV1
SCHEMBL2933994 0.90 EGFR (0.42) NPC1RAB9AGCGRP2RY1TRPV1
SCHEMBL2936066 0.90 GCGR (0.50) GCGRTRPV1NAMPT
SCHEMBL2935281 0.90 NPC1 (0.46) NPC1RAB9AP2RY1TRPV1PPARG
SCHEMBL2941387 0.89 GCGR (0.43) GCGRIGF1R
SCHEMBL2938673 0.89 GCGR (0.44) GCGRP2RY1TRPV1
SCHEMBL2942206 0.88 GCGR (0.45) GCGRTRPV1
SCHEMBL2941313 0.88 GCGR (0.46) NPC1RAB9AGCGRNAMPT
SCHEMBL2937927 0.88 GCGR (0.47) GCGRP2RY1TRPV1IGF1R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7825115-B2 Cyclic urea compounds, preparation thereof and pharmaceutical use thereof as kinase inhibitors AVENTIS PHARMA S.A. (FR) 2010-11-02 US disclosed
EP-1599464-B1 NOVEL CYCLIC UREA DERIVATIVES, PREPARATION METHOD THEREOF AND PHARMACEUTICAL USE OF SAME AS KINASE INHIBITORS AVENTIS PHARMA SA (FR) 2010-09-22 EP disclosed
US-20080108654-A1 Cyclic Urea Compounds, Preparation Thereof and Pharmaceutical Use Thereof as Kinase Inhibitors AVENTIS PHARMA S.A. (FR) 2008-05-08 US disclosed
US-7354933-B2 Protein kinase inhibitors; antitumor agents; such as 5-methyl-1-quinol-4-ylmethyl-3-(4-trifluoromethanesulfonylphenyl)imidazolidine-2,4-dione trifluoroacetate AVENTIS PHARMA SA (FR) 2008-04-08 US disclosed
US-20040248884-A1 Novel cyclic urea derivatives, preparation thereof and pharmaceutical use thereof as kinase inhibitors AVENTIS PHARMA S.A. (FR) 2004-12-09 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 (2 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-20080108654-A1 Cyclic Urea Compounds, Preparation Thereof and Pharmaceutical Use Thereof as Kinase Inhibitors PRKG1, PRKACA, CMPK1 NPC1 2549/4885RAB9A 1706/4885GCGR 2462/4885
US-20040248884-A1 Novel cyclic urea derivatives, preparation thereof and pharmaceutical use thereof as kinase inhibitors PRKG1, PRKACA, PRKCA NPC1 2042/4885RAB9A 2275/4885GCGR 2407/4885

“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.