SCHEMBL649493

SCHEMBL649493

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

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.42
ALDH1A1 P00352 3/20 0.42
TP53 P04637 2/20 0.42
CYP2D6 P10635 2/20 0.33
CYP2C19 P33261 1/20 0.33
HIF1A Q16665 1/20 0.33
ACACB O00763 1/20 0.33
ACACA Q13085 1/20 0.33
CYP1A2 P05177 1/20 0.33
TET2 Q6N021 1/20 0.32
MAPT P10636 1/20 0.31
PTGS1 P23219 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
SCHEMBL8995128 0.80 ALDH1A1 (0.33) TSHRALDH1A1TP53CYP2D6CYP1A2
SCHEMBL28895411 0.78 THRA (0.44) MAPT
SCHEMBL7138576 0.78 TSHR (0.44) TSHRALDH1A1TP53CYP2D6CYP2C19
SCHEMBL283644 0.78 ALDH1A1 (0.44) TSHRALDH1A1TP53CYP2D6CYP2C19
SCHEMBL1548185 0.75
Ammonia Solution, Strong SCHEMBL5978210 0.75 ALDH1A1 (0.42) TSHRALDH1A1TP53CYP2D6CYP2C19
SCHEMBL28704882 0.75 ALDH1A1 (0.42) TSHRALDH1A1TP53CYP2D6CYP2C19
SCHEMBL26679456 0.75
SCHEMBL183284 0.73
SCHEMBL262333 0.73

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 297 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-20110045741-A1 Auto-Stopping Abrasive Composition for Polishing High Step Height Oxide Layer TECHNO SEMICHEM CO., LTD. (KR) 2011-02-24 US claimed
US-20090149596-A1 WATER DISPERSIBLE, HYDROXYL-TERMINATED, FLUORINATED POLYURETHANES AND METHOD OF PREPARING THE SAME PRC-DESOTO INTERNATIONAL, INC. 2009-06-11 US claimed
WO-2006115393-A1 AUTO-STOPPING ABRASIVE COMPOSITION FOR POLISHING HIGH STEP HEIGHT OXIDE LAYER TECHNO SEMICHEM CO., LTD. (KR) 2006-11-02 WO claimed
US-6174956-B1 POLYURETHANES IN DISPERSANTS AND CHAIN EXTENSION NATIONAL STARCH AND CHEMICAL INVESTMENT HOLDING CORPORATION 2001-01-16 US claimed
EP-0531510-A4 POST-EXTENDED ANIONIC POLYURETHANE DISPERSION 1993-09-01 EP claimed
EP-0531510-A1 POST-EXTENDED ANIONIC POLYURETHANE DISPERSION BASF CORPORATION (US) 1993-03-17 EP claimed
WO-1992017546-A1 POST-EXTENDED ANIONIC POLYURETHANE DISPERSION BASF CORPORATION (US) 1992-10-15 WO claimed
US-4870141-A AUTOMOBILE BODY PRIMERS E. I. DU PONT DE NEMOURS AND COMPANY (US) 1989-09-26 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-4742129-A HIGH SOLID, WEAR RESISTANT AUTOMOBILE PRIMER E. I. DU PONT DE NEMOURS AND COMPANY (US) 1988-05-03 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