SCHEMBL8938017

SCHEMBL8938017

[c]1ccc(-c2ccccc2)cc1-c1ccc(-c2ccccc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.41
ALDH1A1 P00352 3/20 0.41
ACMSD Q8TDX5 3/20 0.39
HNF4A P41235 2/20 0.39
DHFR P00374 1/20 0.39
MCL1 Q07820 1/20 0.39
MAOA P21397 1/20 0.38
MEN1 O00255 4/20 0.38
KMT2A Q03164 4/20 0.38
ESR2 Q92731 3/20 0.38
MAPT P10636 3/20 0.38
ESR1 P03372 3/20 0.38
HSD17B10 Q99714 2/20 0.38
KDM4E B2RXH2 2/20 0.38
LMNA P02545 2/20 0.38
GAA P10253 2/20 0.38
HTT P42858 2/20 0.38
USP2 O75604 1/20 0.38
HSP90AA1 P07900 1/20 0.38
HPGD P15428 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
SCHEMBL1451004 0.98 ALDH1A1 (0.43) ALOX5ALDH1A1ACMSDHNF4ADHFR
SCHEMBL1535844 0.95 ALDH1A1 (0.38) ALOX5ALDH1A1ACMSDHNF4ADHFR
SCHEMBL18221938 0.91 ALDH1A1 (0.38) ALOX5ALDH1A1ACMSDHNF4ADHFR
SCHEMBL15067523 0.91 ALDH1A1 (0.45) ALOX5ALDH1A1ACMSDHNF4ADHFR
SCHEMBL9706195 0.90 NPC1 (0.41) ALDH1A1MCL1MEN1KMT2AMAPT
SCHEMBL7995315 0.90 HSD17B10 (0.56) ALOX5ALDH1A1ACMSDHNF4ADHFR
SCHEMBL7455536 0.90 FLT3 (0.39) ALOX5MEN1KMT2AESR2TAAR1
SCHEMBL2341383 0.90 MMP3 (0.56) ALOX5ACMSDHNF4ADHFRMCL1
SCHEMBL7703865 0.87 GSTP1 (0.44) MCL1MAOAMEN1KMT2ABCL2L1
SCHEMBL21635205 0.86 HSD17B1 (0.47) ALOX5ALDH1A1ACMSDMEN1KMT2A

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-5508273-A ARALKYLPHOSPHONATES FOR OSTEOPOROSIS ORTHO PHARMACEUTICAL CORPORATION (US) 1996-04-16 US disclosed