SCHEMBL9219495

SCHEMBL9219495

Cc1cccc2c(-c3ccc(Cl)cc3)c(C(=O)O)oc12

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 5/20 0.60
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
TP53 P04637 2/20 0.40
KDM4E B2RXH2 3/20 0.40
HPGD P15428 2/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
TNKS O95271 1/20 0.39
TNKS2 Q9H2K2 1/20 0.39
PARP2 Q9UGN5 1/20 0.39
ALDH1A1 P00352 1/20 0.39
DHODH Q02127 1/20 0.39
RPA1 P27694 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
GAA P10253 1/20 0.39
ALOX5 P09917 1/20 0.38
ALOX5AP P20292 1/20 0.38

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
SCHEMBL9219618 0.82 DHODH (0.45) MCL1NPC1RAB9ATP53DHODH
SCHEMBL9211334 0.82 TP53 (0.59) MEN1KMT2ATP53KDM4EHPGD
SCHEMBL9218345 0.77 CA1 (0.56) MCL1MEN1KMT2ANPC1RAB9A
SCHEMBL11748492 0.76 MCL1 (1.00) MCL1NPC1RAB9AKDM4EHPGD
SCHEMBL9219499 0.75 MCL1 (0.46) MCL1MEN1KMT2ANPC1RAB9A
SCHEMBL28429215 0.75 MEN1 (0.49) MCL1MEN1KMT2ANPC1RAB9A
SCHEMBL6804369 0.74 MYC (0.54) KMT2ANPC1RAB9ATP53KDM4E
SCHEMBL28190104 0.73 MCL1 (0.71) MCL1NPC1RAB9AKDM4EHPGD
Hydrochloric Acid SCHEMBL7907584 0.73 MYC (0.53) KMT2ANPC1RAB9ATP53KDM4E
SCHEMBL4505303 0.73 ATM (0.38) MEN1KMT2ARAB9ATP53L3MBTL1

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 3 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
CN-1067886-A New urea derivatives, their preparation method and pharmaceutical composition thereof FUJISAWA PHARMACEUTICAL CO (JP) 1993-01-13 CN 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