SCHEMBL8723116

SCHEMBL8723116

C=C(C)C(=O)Oc1ccc2ccccc2c1OC(=O)C(=C)C

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NCEH1 Q6PIU2 12/20 0.46
LMNA P02545 2/20 0.43
ELANE P08246 1/20 0.43
ALDH1A1 P00352 1/20 0.41
PGR P06401 1/20 0.41
GAA P10253 1/20 0.41
PTGS1 P23219 1/20 0.41
MAPK1 P28482 1/20 0.41
HSD17B10 Q99714 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.40
NPC1 O15118 1/20 0.40
MAPT P10636 1/20 0.40
RAB9A P51151 1/20 0.40
MTNR1A P48039 2/20 0.40
MTNR1B P49286 2/20 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
SCHEMBL30226953 0.95 NCEH1 (0.44) NCEH1LMNAELANEALDH1A1GAA
SCHEMBL30226863 0.89 ELANE (0.43) NCEH1LMNAELANEALDH1A1GAA
SCHEMBL11963920 0.89 NCEH1 (0.40) NCEH1LMNAELANEGAASMN1; SMN2
SCHEMBL819579 0.86 MAPT (0.42) NCEH1LMNAELANEALDH1A1PGR
SCHEMBL998061 0.86 ELANE (0.42) NCEH1ELANEALDH1A1GAAHSD17B10
SCHEMBL12416577 0.85 MAPT (0.53) NCEH1LMNAELANEALDH1A1PGR
SCHEMBL13588230 0.84 HPGD (0.42) NCEH1LMNAELANEALDH1A1GAA
SCHEMBL417333 0.83 ELANE (0.45) NCEH1ELANEALDH1A1PGRGAA
SCHEMBL16641159 0.83 ELANE (0.38) NCEH1ELANEALDH1A1GAAMAPT
SCHEMBL11982347 0.83 WDR5 (0.50) LMNAELANEALDH1A1PTGS1MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103380177-B Crosslinkable resin molded body, crosslinked resin molded body, and laminate 日本瑞翁株式会社 2017-04-26 CN disclosed
US-5708064-A CONTAINING THERMOSETTING RESIN PPG INDUSTRIES, INC. (US) 1998-01-13 US disclosed
WO-1995010790-A1 HIGH REFRACTIVE INDEX PHOTOCHROMIC OPHTHALMIC ARTICLE PPG INDUSTRIES, INC. (US) 1995-04-20 WO disclosed
US-4008083-A Stabilization of color images formed by photomodulation of the Christiansen effect E. I. DU PONT DE NEMOURS AND COMPANY (US) 1977-02-15 US disclosed