SCHEMBL7897294

SCHEMBL7897294

C=C(C)C(=O)OC.C=CC(=O)OC1CC2CCC1(C)C2(C)C

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 1/20 0.49
ELANE P08246 2/20 0.47
MAPT P10636 3/20 0.46
KDM4E B2RXH2 1/20 0.46
GAA P10253 1/20 0.46
XBP1 P17861 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
MAPK1 P28482 2/20 0.44
KMT2A Q03164 2/20 0.44
ALDH1A1 P00352 1/20 0.44
LMNA P02545 1/20 0.44
MEN1 O00255 1/20 0.43

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
SCHEMBL28161325 1.00 CYP2C19 (0.49) CYP2C19ELANEMAPTKDM4EGAA
SCHEMBL7897292 1.00 CYP2C19 (0.49) CYP2C19ELANEMAPTKDM4EGAA
SCHEMBL8064810 0.93 CYP2C19 (0.51) CYP2C19ELANEMAPTKDM4EGAA
SCHEMBL8064815 0.93 CYP2C19 (0.51) CYP2C19ELANEMAPTKDM4EGAA
Acrylic Acid Ethyl Ester SCHEMBL3627442 0.92 CYP2C19 (0.43) CYP2C19ELANEMAPTKDM4EGAA
SCHEMBL28145557 0.92 CYP2C19 (0.47) CYP2C19ELANEMAPTKDM4EGAA
Acrylic Acid Methyl Ester SCHEMBL28059502 0.90 CYP2C19 (0.46) CYP2C19ELANEMAPTKDM4EGAA
Acrylic Acid Methyl Ester SCHEMBL16827218 0.90 CYP2C19 (0.46) CYP2C19ELANEMAPTKDM4EGAA
SCHEMBL3204032 0.90 CYP2C19 (0.55) CYP2C19ELANEMAPTKDM4EGAA
Methacrylic Acid SCHEMBL931985 0.89 CYP2C19 (0.55) CYP2C19ELANEMAPTKDM4EGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6228941-B1 FOR CURED COATING FILMS HAVING IMPROVED ACID RESISTANCE, TRANSPARENCY, DISCOLORATION INHIBITION, WEATHERPROOFING, WEAR RESISTANCE, AND SEALER CRACKING RESISTANCE SHELL OIL COMPANY 2001-05-08 US claimed
EP-1042379-A1 COPOLYMERS OF ETHYLENICALLY UNSATURATED MONOMERS TO BE USED IN POWDER COATINGS SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 2000-10-11 EP claimed
WO-1999033889-A1 COPOLYMERS OF ETHYLENICALLY UNSATURATED MONOMERS TO BE USED IN POWDER COATINGS SHELL INTERNATIONALE RESEARCH MAATSCHAPPIJ B.V. (NL) 1999-07-08 WO claimed
CN-105086916-A High-light-transmittance UV-moisture dual-curing adhesive WAERMTIMO TIAJIN ADCANCED MATERIALS TECHNOLOGY CO LTD 2015-11-25 CN disclosed
US-8987368-B2 Polymers based on grafted polyolefins BASF SE (DE) 2015-03-24 US disclosed
EP-2776474-A1 POLYMERS BASED ON GRAFTED POLYOLEFINS BASF SE (DE) 2014-09-17 EP disclosed
WO-2013068395-A1 POLYMERS BASED ON GRAFTED POLYOLEFINS BASF SE (DE) 2013-05-16 WO disclosed
US-20130116374-A1 POLYMERS BASED ON GRAFTED POLYOLEFINS BASF SE (DE) 2013-05-09 US disclosed
US-4683273-A GRAFT POLYMER, PROTECTIVE COATING THE GLIDDEN COMPANY (US) 1987-07-28 US disclosed