SCHEMBL220745

SCHEMBL220745

CCC(O)C(C)(C(=O)O)C(O)CC

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.50
ALDH1A1 P00352 1/20 0.36
CYP2D6 P10635 1/20 0.35
CYP2C19 P33261 1/20 0.35
HIF1A Q16665 1/20 0.35
CA2 P00918 1/20 0.34
MAPK1 P28482 1/20 0.34
ACACB O00763 1/20 0.34
ACACA Q13085 1/20 0.34
TET2 Q6N021 1/20 0.33
FFAR3 O14843 1/20 0.32
PGD P52209 1/20 0.31
HMGCR P04035 1/20 0.31
CHRM1 P11229 1/20 0.31
TBXA2R P21731 1/20 0.31
ADRA1A P35348 1/20 0.31

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
SCHEMBL11837660 0.80 CHRM1 (0.42) TSHRALDH1A1CA2MAPK1ACACB
SCHEMBL28133883 0.79 TSHR (0.50) TSHRALDH1A1CYP2D6CYP2C19HIF1A
SCHEMBL5432238 0.79 OR51E2 (0.38) TSHRALDH1A1CYP2D6CYP2C19HIF1A
SCHEMBL3646440 0.79 TSHR (0.50) TSHRALDH1A1CYP2D6CYP2C19HIF1A
SCHEMBL446452 0.77 TSHR (0.48) TSHRALDH1A1CYP2D6CYP2C19HIF1A
SCHEMBL11487638 0.77 TSHR (0.48) TSHRALDH1A1CYP2D6CYP2C19HIF1A
SCHEMBL11837636 0.77 CA2 (0.48) CA2MAPK1
SCHEMBL6336942 0.75 TSHR (0.46) TSHRALDH1A1CYP2D6CYP2C19HIF1A
SCHEMBL5051493 0.75 TSHR (0.46) TSHRALDH1A1CYP2D6CYP2C19HIF1A
SCHEMBL587731 0.75 TSHR (0.46) TSHRALDH1A1CYP2D6CYP2C19HIF1A

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 116 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2016109193-A1 COATED PROPPANTS CONTAINING HYPERBRANCHED POLYURETHANE COATINGS AND METHODS FOR USING SAME GEORGIA-PACIFIC CHEMICALS LLC (US) 2016-07-07 WO claimed
US-20160186049-A1 COATED PROPPANTS CONTAINING HYPERBRANCHED POLYURETHANE COATINGS AND METHODS FOR USING SAME GEORGIA-PACIFIC CHEMICALS LLC (US) 2016-06-30 US claimed
US-4870141-A AUTOMOBILE BODY PRIMERS E. I. DU PONT DE NEMOURS AND COMPANY (US) 1989-09-26 US claimed
EP-0148579-B1 THERMOSETTING COATING COMPOSITION E.I. DU PONT DE NEMOURS AND COMPANY (US) 1989-08-02 EP claimed
US-4812535-A AUTOMOBILE PRIMER, POLYLACTONES E. I. DUPONT DE NEMOURS AND COMPANY (US) 1989-03-14 US claimed
US-4794149-A WEAR RESISTANT AUTOMOBILE PRIMER E. I. DU PONT DE NEMOURS AND COMPANY (US) 1988-12-27 US claimed
US-4786691-A PROTECTIVE AUTOMOBILE COATINGS E. I. DU PONT DE NEMOURS AND COMPANY (US) 1988-11-22 US claimed
US-4778861-A CORROSION, WEAR RESISTANT HIGH SOLID COATINGS E. I. DU PONT DE NEMOURS AND COMPANY (US) 1988-10-18 US claimed
US-4767829-A POLYLACTONES, BLOCKED ISOCYANATE CROSSLINKING AGENTS, POLYEPOXIDES E. I. DU PONT DE NEMOURS AND COMPANY (US) 1988-08-30 US claimed
US-4754002-A EPOXY ESTER, POLYCAPROLACTONE DIOL, BLOCKED ISOCYANATE E. I. DU PONT DE NEMOURS AND COMPANY (US) 1988-06-28 US claimed
US-4713425-A HYDROXY FUNCTIONAL EPOXY ESTER RESIN, POLYLACTONE, BLOCKED POLYISOCYANATE; FOR AUTOMOBILES E. I. DU PONT DE NEMOURS AND COMPANY (US) 1987-12-15 US claimed
US-4701502-A SOLVENT-BASED THERMOSETTING RESIN FROM BLEND OF EPOXY ESTER RESIN, POLYCAPROLACTONE AND BLOCKED DIISOCYANATE; AUTOMOBILES E. I. DU PONT DE NEMOURS AND COMPANY (US) 1987-10-20 US claimed
US-4699957-A Chip resistant primer composition V E. I. DU PONT DE NEMOURS AND COMPANY (US) 1987-10-13 US claimed
US-4550154-A HYDROXYFUNCTIONAL EPOXY ESTER RESIN AND CROSSLINKER FORD MOTOR COMPANY (US) 1985-10-29 US claimed
EP-0148579-A2 Thermosetting coating composition E.I. DU PONT DE NEMOURS AND COMPANY (US) 1985-07-17 EP claimed
US-4525569-A CURABLE MIXTURE OF DICARBOXYLIC ACIDREACTED DIEPOXIDE, AMINO RESIN OR BLOCKED POLYISOCYANATE AND SOLVENT; CAR PRIMERS FORD MOTOR COMPANY (US) 1985-06-25 US claimed
US-4504606-A HYDROXY FUNCTIONAL EPOXY ESTER RESIN, AMINOPLAST OR BLOCKED POLYIS FORD MOTOR COMPANY (US) 1985-03-12 US claimed
EP-4692160-A1 ACTIVE ENERGY RAY-CURABLE COMPOSITION, ADHESIVE, AND ADHESIVE SHEET Mitsubishi Chemical Corporation (JP) 2026-02-11 EP disclosed
US-4480084-A EXPOY RESING, POLYALKYLPIPERIDINE, AND HYDROXY FUNCTIONAL MONOMER FORD MOTOR COMPANY (US) 1984-10-30 US disclosed
US-3996144-A POLYHYDRIC ESTER TEXACO INC. (US) 1976-12-07 US disclosed