SCHEMBL31556089

SCHEMBL31556089

COc1ccccc1Cc1cc(Br)ccc1C=O

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.53
SMN1; SMN2 Q16637 2/20 0.53
KDM4E B2RXH2 1/20 0.53
MEN1 O00255 1/20 0.53
KMT2A Q03164 1/20 0.53
LMNA P02545 1/20 0.45
CSNK1D P48730 1/20 0.44
CNR2 P34972 2/20 0.42
PRKDC P78527 1/20 0.41
FPR1 P21462 1/20 0.41
MAPT P10636 2/20 0.41
NPC1 O15118 1/20 0.41
HTT P42858 1/20 0.41
RAB9A P51151 1/20 0.41
ERN1 O75460 1/20 0.41
CHRM2 P08172 1/20 0.40
CHRM1 P11229 1/20 0.40
CHRM3 P20309 1/20 0.40
GPR55 Q9Y2T6 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
SCHEMBL2475512 0.83 TLR2 (0.51) ALDH1A1SMN1; SMN2LMNACNR2HTT
SCHEMBL27757810 0.77 ERN1 (0.43) ALDH1A1SMN1; SMN2MEN1KMT2ALMNA
SCHEMBL17508112 0.75 ALDH1A1 (0.48) ALDH1A1SMN1; SMN2KDM4EMEN1KMT2A
SCHEMBL3091346 0.75 KMT2A (0.54) ALDH1A1SMN1; SMN2KDM4EMEN1KMT2A
SCHEMBL31556092 0.75 ALDH1A1 (0.57) ALDH1A1SMN1; SMN2KDM4EMEN1KMT2A
SCHEMBL16321443 0.75 ALDH1A1 (0.56) ALDH1A1SMN1; SMN2KDM4EMEN1KMT2A
SCHEMBL30178662 0.74 ALDH1A1 (0.63) ALDH1A1KDM4ELMNAPRKDCNPC1
SCHEMBL11173 0.74 ALDH1A1 (0.63) ALDH1A1KDM4ELMNAPRKDCNPC1
SCHEMBL3296809 0.74 IDO1 (0.61) ALDH1A1SMN1; SMN2LMNACNR2MAPT
SCHEMBL8281933 0.73 ERN1 (0.43) ALDH1A1SMN1; SMN2KDM4EMEN1KMT2A

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
WO-2025081982-A1 PREPARATION METHOD FOR FINERENONE KEY INTERMEDIATE 山东诚创蓝海医药科技有限公司 2025-04-24 WO disclosed