SCHEMBL9213858

SCHEMBL9213858

CCCc1ccc(-c2c(C(=O)O)oc3ccc(C)cc23)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.49
RAB9A P51151 3/20 0.45
KMT2A Q03164 3/20 0.44
MEN1 O00255 2/20 0.44
ALDH1A1 P00352 3/20 0.42
MCL1 Q07820 2/20 0.42
POLB P06746 1/20 0.42
THRB P10828 1/20 0.42
KDM4E B2RXH2 3/20 0.41
PTPN1 P18031 1/20 0.41
KCNH2 Q12809 1/20 0.41
MAPT P10636 4/20 0.41
ATM Q13315 1/20 0.41
TP53 P04637 3/20 0.41
NPC1 O15118 2/20 0.41
HPGD P15428 1/20 0.41
HTT P42858 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
PKM P14618 1/20 0.40
RXFP1 Q9HBX9 1/20 0.40

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
SCHEMBL9212323 0.87 L3MBTL1 (0.51) L3MBTL1RAB9AKMT2AMEN1ALDH1A1
SCHEMBL8201626 0.83 L3MBTL1 (0.60) L3MBTL1RAB9AKMT2AMEN1ALDH1A1
SCHEMBL9209323 0.82 L3MBTL1 (0.47) L3MBTL1RAB9AKMT2AMEN1ALDH1A1
SCHEMBL9221054 0.82 MAPT (0.54) L3MBTL1RAB9AKMT2AMEN1ALDH1A1
SCHEMBL9210201 0.82 MCL1 (0.57) L3MBTL1RAB9AKMT2AMEN1ALDH1A1
SCHEMBL9212117 0.81 TP53 (0.51) L3MBTL1RAB9AKMT2AMEN1ALDH1A1
SCHEMBL9213874 0.79 LDHA (0.43) RAB9AKMT2AMEN1ALDH1A1MCL1
SCHEMBL9220492 0.76 MCL1 (0.65) RAB9AKMT2AMEN1ALDH1A1MCL1
SCHEMBL9219788 0.76 MCL1 (0.50) L3MBTL1KMT2AMEN1ALDH1A1MCL1
SCHEMBL9430605 0.75 TP53 (0.71) L3MBTL1RAB9AKMT2AMEN1ALDH1A1

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