SCHEMBL3764676

SCHEMBL3764676

S=C(NC1=CC2(CCC2)Oc2ccccc21)Nc1cccc2ccncc12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 16/20 0.42
MAPT P10636 13/20 0.42
KDM4E B2RXH2 11/20 0.42
SMN1; SMN2 Q16637 9/20 0.42
KMT2A Q03164 6/20 0.42
LMNA P02545 6/20 0.40
NSD2 O96028 1/20 0.40
HTT P42858 4/20 0.39
MEN1 O00255 4/20 0.39
BLM P54132 3/20 0.39
HPGD P15428 2/20 0.39
THRB P10828 1/20 0.39
CASP3 P42574 1/20 0.39
SENP8 Q96LD8 1/20 0.39
SENP7 Q9BQF6 1/20 0.39
SENP6 Q9GZR1 1/20 0.39
CCNE1 P24864 1/20 0.38
CDK2 P24941 1/20 0.38
CDK5 Q00535 1/20 0.38
L3MBTL1 Q9Y468 2/20 0.37

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
SCHEMBL3759622 0.92 ALDH1A1 (0.52) ALDH1A1MAPTKDM4ESMN1; SMN2KMT2A
SCHEMBL3758650 0.72 TRPV1 (0.51) ALDH1A1MAPTKDM4ESMN1; SMN2KMT2A
SCHEMBL620269 0.67 TRPV1 (0.43) ALDH1A1MAPTKDM4ESMN1; SMN2KMT2A
SCHEMBL3756316 0.65 PARP1 (0.46)
SCHEMBL3758877 0.65 TRPV1 (0.60) ALDH1A1MAPTKDM4ESMN1; SMN2KMT2A
SCHEMBL620565 0.65 TRPV1 (0.65) ALDH1A1KDM4ESMN1; SMN2HPGDCCNE1
SCHEMBL3759579 0.64 ALDH1A1 (0.52) ALDH1A1MAPTKDM4ESMN1; SMN2KMT2A
SCHEMBL2321594 0.62 KDM4E (0.67) ALDH1A1MAPTKDM4ESMN1; SMN2KMT2A
SCHEMBL30600745 0.61 TRPV1 (0.52) ALDH1A1MAPTKDM4ESMN1; SMN2KMT2A
SCHEMBL1275812 0.61 KMT2A (0.72) ALDH1A1KDM4ESMN1; SMN2KMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1931681-B1 SUBSTITUTED BENZOFUSED DERIVATIVES AND THEIR USE AS VANILLOID RECEPTOR LIGANDS GLENMARK PHARMACEUTICALS SA (CH) 2012-11-14 EP claimed
US-20080269253-A1 Substituted Benzofused Derivatives and Their Use as Vanilloid Receptor Ligands GLENMARK PHARMACEUTICALS, S.A. (CH) 2008-10-30 US claimed
EP-1931681-B1 SUBSTITUTED BENZOFUSED DERIVATIVES AND THEIR USE AS VANILLOID RECEPTOR LIGANDS GLENMARK PHARMACEUTICALS SA (CH) 2012-11-14 EP disclosed
US-20120277259-A1 SUBSTITUTED BENZOFUSED DERIVATIVES AND THEIR USE AS VANILLOID RECEPTOR LIGANDS GLENMARK PHARMACEUTICALS S.A. (CH) 2012-11-01 US disclosed
US-7842703-B2 Substituted benzofused derivatives and their use as vanilloid receptor ligands GLENMARK PHARMACEUTICALS S.A. (CH) 2010-11-30 US disclosed
US-20080269253-A1 Substituted Benzofused Derivatives and Their Use as Vanilloid Receptor Ligands GLENMARK PHARMACEUTICALS, S.A. (CH) 2008-10-30 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-20080269253-A1 Substituted Benzofused Derivatives and Their Use as Vanilloid Receptor Ligands TRPV1, GPR17, TRPV6 ALDH1A1 665/4885MAPT 3909/4885KDM4E 2842/4885
US-20120277259-A1 SUBSTITUTED BENZOFUSED DERIVATIVES AND THEIR USE AS VANILLOID RECEPTOR LIGANDS TRPV1, GPR17, TRPV6 ALDH1A1 665/4885MAPT 3909/4885KDM4E 2842/4885

“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.