SCHEMBL245184

SCHEMBL245184

C=CCC(O)(C(=O)c1ccccc1)c1ccccc1.CCCCCOCCCCC

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.44
ALDH1A1 P00352 2/20 0.44
HTT P42858 1/20 0.43
CES1 P23141 3/20 0.38
CES2 O00748 2/20 0.38
TP53 P04637 2/20 0.38
CYP3A4 P08684 1/20 0.38
MAPK1 P28482 1/20 0.38
LMNA P02545 2/20 0.37
NAAA Q02083 1/20 0.36
PPARG P37231 1/20 0.36
RECQL P46063 1/20 0.36

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
SCHEMBL11586950 0.99 TSHR (0.43) TSHRALDH1A1HTTCES1CES2
SCHEMBL11585318 0.99 TSHR (0.43) TSHRALDH1A1HTTCES1CES2
SCHEMBL11586797 0.96 TSHR (0.46) TSHRALDH1A1HTTCES1CES2
SCHEMBL11588492 0.91 ALDH1A1 (0.44) TSHRALDH1A1HTTCES1LMNA
Ether SCHEMBL9750209 0.85 ALDH1A1 (0.46) TSHRALDH1A1HTTCES1MAPK1
Methoxymethane SCHEMBL9749754 0.84 TSHR (0.50) TSHRALDH1A1HTTCES1CYP3A4
SCHEMBL197860 0.84 ALDH1A1 (0.56) TSHRALDH1A1HTTCES1CYP3A4
SCHEMBL10398398 0.81 ALDH1A1 (0.47) TSHRALDH1A1HTTCES1CYP3A4
SCHEMBL11320202 0.80 PLA2G4B (0.43) TSHRALDH1A1CES1CES2TP53
SCHEMBL11307176 0.80 PLA2G4B (0.43) TSHRALDH1A1CES1CES2TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9564638-B2 Battery electrode or separator surface protective agent composition, battery electrode or separator protected by the composition, and battery having the battery electrode or separator KYORITSU CHEMICAL & CO., LTD. (JP) 2017-02-07 US disclosed
US-20130260207-A1 BATTERY ELECTRODE OR SEPARATOR SURFACE PROTECTIVE AGENT COMPOSITION, BATTERY ELECTRODE OR SEPARATOR PROTECTED BY THE COMPOSITION, AND BATTERY HAVING THE BATTERY ELECTRODE OR SEPARATOR KYORITSU CHEMICAL & CO., LTD. (JP) 2013-10-03 US disclosed
US-8087747-B2 Ink jet recording head unit and production process thereof CANON KABUSHIKI KAISHA (JP) 2012-01-03 US disclosed
US-20090066771-A1 INK JET RECORDING HEAD UNIT AND PRODUCTION PROCESS THEREOF CANON KABUSHIKI KAISHA (JP) 2009-03-12 US disclosed
US-6164785-A Antiglaring film DAI NIPPON PRINTING CO., LTD. (JP) 2000-12-26 US disclosed