SCHEMBL784937

SCHEMBL784937

Cc1ccc(NC(=O)NC2CCCc3ccc(C(=O)N(C)C4CCN(c5ccncc5)CC4)cc32)c(C)c1

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.41
CTSS P25774 1/20 0.38
MAPK1 P28482 1/20 0.38
TRPV1 Q8NER1 2/20 0.38
FPR1 P21462 1/20 0.37
FPR2 P25090 1/20 0.37
ATM Q13315 2/20 0.37
MAPT P10636 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
ROCK2 O75116 2/20 0.35
ROCK1 Q13464 2/20 0.35
EPHX2 P34913 1/20 0.35
GAA P10253 1/20 0.35
RAB9A P51151 1/20 0.35
PDGFRB P09619 1/20 0.35
KDR P35968 1/20 0.35
TAS1R3 Q7RTX0 2/20 0.35
TAS1R1 Q7RTX1 2/20 0.35
NPSR1 Q6W5P4 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
SCHEMBL785701 0.87 TAS1R3 (0.41) KMT2ACTSSMAPK1TRPV1FPR1
SCHEMBL784541 0.86 NTRK1 (0.35) KMT2ATRPV1FPR1FPR2ATM
SCHEMBL785511 0.86 TAS1R3 (0.52) KMT2ACTSSMAPK1TRPV1ATM
SCHEMBL785937 0.86 TRPV1 (0.40) KMT2ACTSSTRPV1FPR1FPR2
SCHEMBL784642 0.86 TRPV1 (0.46) KMT2ACTSSMAPK1TRPV1MAPT
SCHEMBL785726 0.86 TAS1R3 (0.41) KMT2ACTSSMAPK1TRPV1FPR1
SCHEMBL785815 0.86 TRPV1 (0.44) MAPK1TRPV1FPR1FPR2ROCK2
SCHEMBL784618 0.85 TAS1R3 (0.45) KMT2ACTSSMAPK1TRPV1ATM
SCHEMBL785666 0.85 TRPV1 (0.44) CTSSMAPK1TRPV1FPR1FPR2
SCHEMBL785734 0.85 CTSS (0.44) CTSSMAPK1MAPTSMN1; 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 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 KMT2A 2222/4885CTSS 824/4885MAPK1 1137/4885

“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.