SCHEMBL9153633

SCHEMBL9153633

CN(C(=O)CN(C(=O)CN1C(=O)c2ccccc2C1=O)c1ccccc1)c1ccccc1F

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.47
MEN1 O00255 1/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
KMT2A Q03164 1/20 0.43
POLB P06746 4/20 0.43
TSHR P16473 2/20 0.43
CA12 O43570 1/20 0.43
CA9 Q16790 1/20 0.43
RECQL P46063 1/20 0.42
GAA P10253 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.40
KDM4E B2RXH2 1/20 0.39
LMNA P02545 1/20 0.39
OPRD1 P41143 1/20 0.39

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
SCHEMBL9155505 0.89 ALDH1A1 (0.44) ALDH1A1MEN1NPC1RAB9AKMT2A
SCHEMBL9157349 0.89 ALDH1A1 (0.44) ALDH1A1MEN1NPC1RAB9AKMT2A
SCHEMBL9132781 0.87 RAB9A (0.42) ALDH1A1NPC1RAB9ARECQLGAA
SCHEMBL8860020 0.87 ALDH1A1 (0.55) ALDH1A1MEN1NPC1RAB9AKMT2A
SCHEMBL9154498 0.86 ALDH1A1 (0.47) ALDH1A1MEN1NPC1RAB9AKMT2A
SCHEMBL9158369 0.85 ALDH1A1 (0.52) ALDH1A1MEN1NPC1RAB9AKMT2A
SCHEMBL9153600 0.84 ALDH1A1 (0.45) ALDH1A1MEN1NPC1RAB9AKMT2A
SCHEMBL9152750 0.83 ALDH1A1 (0.46) ALDH1A1MEN1NPC1RAB9AKMT2A
SCHEMBL9152697 0.82 ALDH1A1 (0.50) ALDH1A1MEN1NPC1RAB9AKMT2A
SCHEMBL9154018 0.82 ALDH1A1 (0.50) ALDH1A1MEN1NPC1RAB9AKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5382590-A Gastrointestinal disorders and nervous system disorders RHONE-POULENC RORER S.A. (FR) 1995-01-17 US disclosed