SCHEMBL9026692

SCHEMBL9026692

COc1ccc(Cl)cc1C(N)c1cc2cccc(C)c2o1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 2/20 0.44
ADORA2A P29274 2/20 0.44
SLC6A2 P23975 1/20 0.39
SLC6A4 P31645 1/20 0.39
S1PR2 O95136 1/20 0.38
S1PR4 O95977 1/20 0.38
S1PR1 P21453 1/20 0.38
S1PR3 Q99500 1/20 0.38
S1PR5 Q9H228 1/20 0.38
MAOB P27338 3/20 0.36
MAOA P21397 2/20 0.36
LMNA P02545 1/20 0.36
RECQL P46063 1/20 0.36
CRHR1 P34998 1/20 0.36
CHRM2 P08172 1/20 0.35
CHRM1 P11229 1/20 0.35
RRM1 P23921 1/20 0.35
RRM2B Q7LG56 1/20 0.35
RXFP1 Q9HBX9 2/20 0.35
GAA P10253 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
SCHEMBL9027093 0.89 LMNA (0.36) S1PR2S1PR4S1PR1S1PR3S1PR5
SCHEMBL9025756 0.84 NPC1 (0.44) ADORA3ADORA2ACHRM2CHRM1RXFP1
SCHEMBL9025551 0.81 KDM4E (0.43) SLC6A4LMNARXFP1ALDH1A1KMT2A
SCHEMBL9024526 0.80 ALDH1A1 (0.33) ADORA2ASLC6A2SLC6A4S1PR3LMNA
SCHEMBL9025274 0.77 SLC6A2 (0.36) SLC6A2SLC6A4S1PR3MAOBALDH1A1
SCHEMBL9026705 0.76 SLC6A2 (0.37) SLC6A2SLC6A4S1PR2S1PR4S1PR1
SCHEMBL9026962 0.76 LPAR1 (0.37) SLC6A2SLC6A4S1PR3GAAALDH1A1
SCHEMBL9025806 0.74 MAPT (0.39) ADORA2AMAOBLMNARXFP1ALDH1A1
SCHEMBL9025673 0.73 KMT2A (0.39) MAOBALDH1A1KMT2AMAPTHPGD
SCHEMBL9025095 0.71 MAPT (0.38) S1PR1MAOBMAOALMNAGAA

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-0711290-A1 METHYLGUANIDINE DERIVATIVES, METHODS FOR PREPARING SAME AND COMPOSITIONS CONTAINING SAID DERIVATIVES SANOFI (FR) 1996-05-15 EP disclosed
WO-1995004052-A1 METHYLGUANIDINE DERIVATIVES, METHODS FOR PREPARING SAME AND COMPOSITIONS CONTAINING SAID DERIVATIVES SANOFI (FR) 1995-02-09 WO disclosed