SCHEMBL4022353

SCHEMBL4022353

CCOC(=O)Nc1cccc2cnccc12

nearest known ligand 0.74

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 11/20 0.74
ALDH1A1 P00352 9/20 0.70
HPGD P15428 1/20 0.70
MAPT P10636 6/20 0.56
SMN1; SMN2 Q16637 6/20 0.56
KDM4E B2RXH2 5/20 0.56
LMNA P02545 2/20 0.56
THRB P10828 1/20 0.56
KMT2A Q03164 3/20 0.55
HTT P42858 1/20 0.54
MEN1 O00255 1/20 0.53
APAF1 O14727 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.53

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
SCHEMBL4028212 0.86 TRPV1 (0.65) TRPV1ALDH1A1MAPTSMN1; SMN2KDM4E
SCHEMBL4022954 0.85 TRPV1 (1.00) TRPV1ALDH1A1HPGDMAPTSMN1; SMN2
SCHEMBL283472 0.83 ALDH1A1 (1.00) ALDH1A1HPGDMAPTKDM4ELMNA
SCHEMBL17776532 0.82 TRPV1 (0.62) TRPV1ALDH1A1MAPTSMN1; SMN2KDM4E
SCHEMBL4020193 0.81 TRPV1 (0.67) TRPV1ALDH1A1HPGDMAPTSMN1; SMN2
SCHEMBL3246360 0.81 TRPV1 (0.63) TRPV1ALDH1A1MAPTSMN1; SMN2KDM4E
SCHEMBL30114438 0.81 TRPV1 (0.64) TRPV1ALDH1A1MAPTSMN1; SMN2KDM4E
SCHEMBL4023786 0.81 TRPV1 (0.64) TRPV1ALDH1A1MAPTSMN1; SMN2KDM4E
SCHEMBL16269053 0.81 TRPV1 (0.54) TRPV1ALDH1A1MAPTSMN1; SMN2KDM4E
SCHEMBL16269051 0.81 TRPV1 (0.54) TRPV1ALDH1A1MAPTSMN1; SMN2KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1478363-B1 FUSED AZABICYCLIC COMPOUNDS THAT INHIBIT VANILLOID RECEPTOR SUBTYPE 1 (VR1) RECEPTOR ABBOTT LAB (US) 2009-01-14 EP claimed
EP-1478363-B1 FUSED AZABICYCLIC COMPOUNDS THAT INHIBIT VANILLOID RECEPTOR SUBTYPE 1 (VR1) RECEPTOR ABBOTT LAB (US) 2009-01-14 EP disclosed