SCHEMBL10550275

SCHEMBL10550275

COC(=O)c1cc(F)c(O)nc1Nc1ccc(F)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.44
NPC1 O15118 3/20 0.44
RAB9A P51151 3/20 0.44
CASP3 P42574 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
SENP8 Q96LD8 1/20 0.44
SENP7 Q9BQF6 1/20 0.44
SENP6 Q9GZR1 1/20 0.44
MAPT P10636 3/20 0.43
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
MAPK1 P28482 1/20 0.42
HTT P42858 1/20 0.42
DHODH Q02127 1/20 0.42
PDE5A O76074 1/20 0.41
ABCC1 P33527 1/20 0.41
ABCG2 Q9UNQ0 1/20 0.41
ATM Q13315 1/20 0.41
SLC6A4 P31645 1/20 0.41
SLC6A3 Q01959 1/20 0.41

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
SCHEMBL10550257 0.84 DHODH (0.55) MAPTMEN1KMT2ADHODHABCC1
SCHEMBL10546863 0.84 NPC1 (0.45) NPC1RAB9ASMN1; SMN2MAPTHTT
SCHEMBL10468704 0.79 CA12 (0.39) L3MBTL1NPC1RAB9ACASP3SMN1; SMN2
SCHEMBL10547323 0.79 LMNA (0.44) RAB9ACASP3SMN1; SMN2SENP7MAPT
SCHEMBL10467030 0.75 PGK1 (0.38) L3MBTL1NPC1RAB9ACASP3SMN1; SMN2
SCHEMBL8751819 0.75 CA12 (0.43) L3MBTL1NPC1RAB9ACASP3SMN1; SMN2
SCHEMBL8834288 0.74 MAPT (0.51) L3MBTL1NPC1RAB9ACASP3SMN1; SMN2
SCHEMBL10468563 0.73 ROCK2 (0.54) CDK2HPGDALDH1A1
SCHEMBL15636015 0.73 DHODH (0.72) L3MBTL1NPC1RAB9ASMN1; SMN2MAPT
SCHEMBL10469441 0.73 CHRNA7 (0.40) L3MBTL1SMN1; SMN2MAPTKDM4EHPGD

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
US-4851535-A 2-(5-FLUORONICOTINOYL)ACETIC ACID DERIVATIVES, ANTIBACTERIAL 1-ARYL-1,4-DIHYDRO-4-OXONAPHTHYRIDINES TOYAMA CHEMICAL CO., LTD. (JP) 1989-07-25 US disclosed
US-4704459-A VILSMEIER REAGENT TOYAMA CHEMICAL CO., LTD. (JP) 1987-11-03 US disclosed