SCHEMBL9213874

SCHEMBL9213874

CCCc1ccc(-c2oc(C(=O)O)c3ccc(C)cc23)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LDHA P00338 1/20 0.43
LDHB P07195 1/20 0.43
MCL1 Q07820 1/20 0.43
PDE10A Q9Y233 1/20 0.39
MAPT P10636 5/20 0.39
KDM4E B2RXH2 2/20 0.39
MEN1 O00255 2/20 0.39
ALDH1A1 P00352 2/20 0.39
KMT2A Q03164 2/20 0.39
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
HPGD P15428 1/20 0.39
HTT P42858 1/20 0.39
TP53 P04637 3/20 0.38
RXFP1 Q9HBX9 1/20 0.38
RARB P10826 7/20 0.38
CSNK2A2 P19784 1/20 0.36
CSNK2B P67870 1/20 0.36
CSNK2A1 P68400 1/20 0.36

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
SCHEMBL9212333 0.86 MAPT (0.46) LDHALDHBMCL1MAPTKDM4E
SCHEMBL9212264 0.82 KDM4E (0.55) LDHALDHBMAPTKDM4EMEN1
SCHEMBL9209330 0.81 ANO1 (0.43) LDHALDHBMAPTKDM4EMEN1
SCHEMBL9221063 0.81 ANO1 (0.43) LDHALDHBMAPTKDM4EMEN1
SCHEMBL9210214 0.81 MAPT (0.54) MCL1MAPTKDM4EMEN1ALDH1A1
SCHEMBL9212129 0.81 L3MBTL1 (0.45) MEN1ALDH1A1KMT2ANPC1RAB9A
SCHEMBL9213858 0.79 L3MBTL1 (0.49) MCL1MAPTKDM4EMEN1ALDH1A1
SCHEMBL9220326 0.76 MAPT (0.54) MCL1MAPTKDM4EMEN1ALDH1A1
SCHEMBL9220502 0.76 MCL1 (0.51) MCL1MAPTKDM4EMEN1ALDH1A1
SCHEMBL9219801 0.75 MCL1 (0.42) MCL1MAPTNPC1RAB9ATP53

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-0512570-B1 Urea derivatives, processes for the preparation thereof and pharmaceutical composition comprising the same FUJISAWA PHARMACEUTICAL CO (JP) 1995-10-11 EP disclosed
EP-0512570-A1 Urea derivatives, processes for the preparation thereof and pharmaceutical composition comprising the same FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1992-11-11 EP disclosed