SCHEMBL2730002

SCHEMBL2730002

Cc1n[nH]cc1NCc1cccs1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 6/20 0.47
L3MBTL1 Q9Y468 2/20 0.43
KDM4C Q9H3R0 1/20 0.43
ALDH1A1 P00352 5/20 0.42
KDM4E B2RXH2 3/20 0.42
HPGD P15428 2/20 0.42
TSHR P16473 5/20 0.42
RAB9A P51151 3/20 0.42
KCNH3 Q9ULD8 1/20 0.41
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
NPC1 O15118 1/20 0.41
HTT P42858 1/20 0.41
ADORA3 P0DMS8 1/20 0.41
ADORA2A P29274 1/20 0.41
ADORA2B P29275 1/20 0.41
ADORA1 P30542 1/20 0.41
CYP1A2 P05177 4/20 0.41
CYP3A4 P08684 4/20 0.41
CYP2D6 P10635 4/20 0.41

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
SCHEMBL2729393 0.73 SMN1; SMN2 (0.47) SMN1; SMN2L3MBTL1KDM4CALDH1A1KDM4E
SCHEMBL2728808 0.73 SMN1; SMN2 (0.50) SMN1; SMN2L3MBTL1ALDH1A1KDM4EHPGD
SCHEMBL18690997 0.70 KCNH3 (0.48) SMN1; SMN2L3MBTL1KDM4CALDH1A1HPGD
SCHEMBL2730515 0.69 L3MBTL1 (0.53) SMN1; SMN2L3MBTL1KDM4CALDH1A1KDM4E
SCHEMBL28039915 0.68 ALDH1A1 (0.44) SMN1; SMN2L3MBTL1KDM4CALDH1A1KDM4E
SCHEMBL28039858 0.67 HPGD (0.45) SMN1; SMN2L3MBTL1ALDH1A1KDM4EHPGD
SCHEMBL28823518 0.67 L3MBTL1 (0.45) SMN1; SMN2L3MBTL1ALDH1A1KDM4EHPGD
SCHEMBL15100512 0.67 SMN1; SMN2 (0.41) SMN1; SMN2L3MBTL1ALDH1A1KDM4EHPGD
SCHEMBL2729665 0.67 SMN1; SMN2 (0.47) SMN1; SMN2L3MBTL1KDM4CALDH1A1KDM4E
SCHEMBL10874262 0.67 L3MBTL1 (0.54) SMN1; SMN2L3MBTL1ALDH1A1KDM4EHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108484589-A The useful compound of conditioning agent as TRPM8 赛诺米克斯公司 2018-09-04 CN disclosed
EP-2635572-A2 COMPOUNDS USEFUL AS MODULATORS OF TRPM8 Senomyx, Inc. (US) 2013-09-11 EP disclosed
CN-103201279-A Compounds useful as modulators of TRPM8 SENOMYX INC 2013-07-10 CN disclosed
WO-2012061698-A9 COMPOUNDS USEFUL AS MODULATORS OF TRPM8 SENOMYX, INC. (US) 2012-09-13 WO disclosed
WO-2012061698-A2 COMPOUNDS USEFUL AS MODULATORS OF TRPM8 SENOMYX, INC. (US) 2012-05-10 WO disclosed