SCHEMBL9728960

SCHEMBL9728960

O=C(O)c1cccc(-c2ccc(F)cc2F)c1O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALB P02768 2/20 0.56
ALDH1A1 P00352 3/20 0.55
TTR P02766 2/20 0.55
KDM4E B2RXH2 2/20 0.55
HPGD P15428 2/20 0.55
HSD17B10 Q99714 2/20 0.55
ACMSD Q8TDX5 2/20 0.55
HMGB1 P09429 2/20 0.55
MEN1 O00255 1/20 0.55
USP2 O75604 1/20 0.55
DHFR P00374 1/20 0.55
CA1 P00915 1/20 0.55
CA2 P00918 1/20 0.55
LMNA P02545 1/20 0.55
CXCL12 P48061 1/20 0.55
KMT2A Q03164 1/20 0.55
HIF1A Q16665 1/20 0.55
SLC22A6 Q4U2R8 1/20 0.55
HNF4A P41235 1/20 0.53
HSD17B1 P14061 2/20 0.45

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
SCHEMBL4242281 0.85 ALDH1A1 (0.55) ALBALDH1A1TTRKDM4EHPGD
SCHEMBL6055008 0.83 ALB (0.69) ALBALDH1A1KDM4EHPGDHSD17B10
SCHEMBL5678745 0.80 HNF4A (0.76) ALBALDH1A1KDM4EHPGDHSD17B10
SCHEMBL10948911 0.78 HNF4A (0.73) ALBALDH1A1KDM4EHPGDHSD17B10
SCHEMBL20554531 0.78 ALB (0.67) ALBALDH1A1KDM4EHPGDHSD17B10
SCHEMBL8031425 0.75 HNF4A (0.74) ALBALDH1A1KDM4EHPGDHSD17B10
SCHEMBL30688744 0.75 PIK3R1 (0.40) ALBALDH1A1TTRKDM4EHPGD
SCHEMBL20601776 0.75 ACMSD (0.53) ALBALDH1A1TTRKDM4EHPGD
SCHEMBL21799298 0.75 PIK3R1 (0.40) ALBALDH1A1TTRKDM4EHPGD
SCHEMBL31585927 0.75 ACMSD (0.53) ALBALDH1A1TTRKDM4EHPGD

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
EP-0306060-B1 PHARMACEUTICAL PRODUCTS PROVIDING ENHANCED ANALGESIA THE PROCTER & GAMBLE COMPANY (US) 1992-08-19 EP disclosed
US-4812446-A CAPSAICINOID AND SALICYLATE THE PROCTER & GAMBLE COMPANY (US) 1989-03-14 US disclosed