SCHEMBL784989

SCHEMBL784989

CN(C(=O)c1ccc2c(c1)C(NC(=O)Nc1ccc(F)c(Cl)c1)CC2)C1CCN(c2ccc3cnccc3c2)CC1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PRMT3 O60678 2/20 0.40
NPY5R Q15761 1/20 0.40
TRPV1 Q8NER1 7/20 0.40
FPR1 P21462 1/20 0.37
FPR2 P25090 1/20 0.37
MEN1 O00255 3/20 0.37
KMT2A Q03164 3/20 0.37
ALDH1A1 P00352 1/20 0.37
EGFR P00533 1/20 0.37
MALT1 Q9UDY8 2/20 0.36
LMNA P02545 2/20 0.36
MAPT P10636 1/20 0.36
TP53 P04637 1/20 0.36
HTT P42858 1/20 0.36
CCNC P24863 1/20 0.35
CDK8 P49336 1/20 0.35
F10 P00742 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
SCHEMBL785321 0.88 F10 (0.39) PRMT3NPY5RTRPV1FPR1FPR2
SCHEMBL784689 0.88 F10 (0.39) PRMT3TRPV1FPR1FPR2F10
SCHEMBL785714 0.88 TRPV1 (0.38) PRMT3NPY5RTRPV1F10
SCHEMBL785460 0.87 TRPV1 (0.41) NPY5RTRPV1FPR1FPR2MEN1
SCHEMBL784649 0.87 TAS1R3 (0.41) PRMT3TRPV1
SCHEMBL784419 0.87 TRPV1 (0.47) NPY5RTRPV1FPR1FPR2MEN1
SCHEMBL784714 0.86 TRPV1 (0.42) PRMT3TRPV1
SCHEMBL784019 0.85 TRPV1 (0.40) TRPV1MEN1KMT2AALDH1A1MAPT
SCHEMBL785521 0.85 FPR2 (0.38) PRMT3TRPV1FPR1FPR2F10
SCHEMBL784571 0.85 TRPV1 (0.41) PRMT3TRPV1F10

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 PRMT3 2202/4885NPY5R 54/4885TRPV1 21/4885

“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.