SCHEMBL784571

SCHEMBL784571

CN(C(=O)c1ccc2c(c1)C(NC(=O)NCc1ccc(Cl)cc1Cl)CC2)C1CCN(c2ccc3cnccc3c2)CC1

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 4/20 0.41
F10 P00742 10/20 0.39
EPHX2 P34913 2/20 0.37
PRMT3 O60678 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2J2 P51589 1/20 0.37
ROCK2 O75116 1/20 0.37
F2 P00734 1/20 0.35
PLAT P00750 1/20 0.35
KLKB1 P03952 1/20 0.35
P2RX7 Q99572 1/20 0.35
MAPK1 P28482 1/20 0.35

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
SCHEMBL785529 0.93 TRPV1 (0.40) TRPV1F10PRMT3ROCK2
SCHEMBL784689 0.89 F10 (0.39) TRPV1F10PRMT3F2PLAT
SCHEMBL784712 0.88 EPHX2 (0.44) TRPV1F10EPHX2F2PLAT
SCHEMBL785321 0.87 F10 (0.39) TRPV1F10PRMT3F2PLAT
SCHEMBL785032 0.87 F10 (0.41) F10
SCHEMBL784572 0.86 F10 (0.39) F10F2PLATKLKB1
SCHEMBL784715 0.86 F10 (0.40) F10F2PLATKLKB1
SCHEMBL785521 0.85 FPR2 (0.38) TRPV1F10PRMT3
SCHEMBL784989 0.85 PRMT3 (0.40) TRPV1F10PRMT3
SCHEMBL785714 0.84 TRPV1 (0.38) TRPV1F10PRMT3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8680159-B2 Bradykinin 1 receptor modulating compounds GRUENENTHAL GMBH (DE) 2014-03-25 US claimed
US-20120071461-A1 Substituted Benzamide Compounds GRUENENTHAL GMBH (DE) 2012-03-22 US claimed
US-8680159-B2 Bradykinin 1 receptor modulating compounds GRUENENTHAL GMBH (DE) 2014-03-25 US disclosed
US-20120071461-A1 Substituted Benzamide Compounds GRUENENTHAL GMBH (DE) 2012-03-22 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-20120071461-A1 Substituted Benzamide Compounds BDKRB1, BDKRB2, HRH2 TRPV1 21/4885F10 524/4885EPHX2 1475/4885

“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.