SCHEMBL1011933

SCHEMBL1011933

CCC(CO)(CO)c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNN4 O15554 3/20 0.41
CYP2C19 P33261 2/20 0.39
HIF1A Q16665 1/20 0.39
ALDH1A1 P00352 2/20 0.38
TAAR1 Q96RJ0 1/20 0.38
ALOX15 P16050 1/20 0.38
KDM4E B2RXH2 1/20 0.37
ESR1 P03372 2/20 0.37
ESR2 Q92731 2/20 0.37
CYP3A4 P08684 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2C9 P11712 1/20 0.37
KIF11 P52732 1/20 0.36
MAPK1 P28482 1/20 0.36
MAPT P10636 1/20 0.35
KMT2A Q03164 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
DRD2 P14416 1/20 0.35
OPRM1 P35372 1/20 0.35
DRD3 P35462 1/20 0.35

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
SCHEMBL915727 0.95 KCNN4 (0.41) KCNN4CYP2C19HIF1AALDH1A1TAAR1
Methacrylic Acid SCHEMBL8850766 0.85 CYP2C19 (0.38) KCNN4CYP2C19HIF1AALDH1A1KDM4E
SCHEMBL2672155 0.85 CYP2C19 (0.42) KCNN4CYP2C19HIF1AALDH1A1TAAR1
SCHEMBL2170468 0.85 KCNN4 (0.48) KCNN4CYP2C19HIF1AALDH1A1TAAR1
SCHEMBL11074278 0.82 CYP2C19 (0.43) KCNN4CYP2C19HIF1AALDH1A1CYP1A2
SCHEMBL27649423 0.82 KCNN4 (0.46) KCNN4CYP2C19HIF1AALDH1A1TAAR1
Ammonia Solution, Strong SCHEMBL28211611 0.80 KCNN4 (0.38) KCNN4CYP2C19HIF1AALDH1A1TAAR1
Toluene SCHEMBL9279078 0.79 LMNA (0.50) CYP2C19HIF1AALDH1A1TAAR1ALOX15
SCHEMBL27560936 0.79 KIF11 (0.42) KCNN4ESR1ESR2KIF11KMT2A
SCHEMBL11738915 0.77 LMNA (0.44) CYP2C19ALDH1A1CYP3A4CYP1A2CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021211922-A1 SPIRO-SULFONIMIDAMIDE DERIVATIVES AS INHIBITORS OF MYELOID CELL LEUKEMIA-1 (MCL-1) PROTEIN PRELUDE THERAPEUTICS, INCORPORATED (US) 2021-10-21 WO disclosed
CN-111217856-A Five-membered cyclic phosphate compound and preparation method and application thereof 恒大新能源技术(深圳)有限公司 2020-06-02 CN disclosed
CN-111217855-A Five-membered ring phosphite ester compound and preparation method and application thereof 恒大新能源技术(深圳)有限公司 2020-06-02 CN disclosed
US-7932317-B1 Aqueous coating material and modular system for producing same BASF COATINGS AG (DE) 2011-04-26 US disclosed
EP-1183313-B2 AQUEOUS COATING MATERIAL AND MODULAR SYSTEM FOR PRODUCING SAME BASF COATINGS GMBH (DE) 2011-01-05 EP disclosed
EP-1135424-B2 COATING AGENT CONSISTING OF AT LEAST THREE COMPONENTS, METHOD FOR PRODUCING SAME AND ITS UTILISATION BASF COATINGS AG (DE) 2007-05-02 EP disclosed
EP-1165646-B1 COATING SUBSTANCE CONSISTING OF AT LEAST THREE COMPONENTS, METHOD FOR PRODUCING SAID COATING SUBSTANCE AND USE THEREOF BASF COATINGS AG (DE) 2006-09-20 EP disclosed
US-6946515-B1 Coating substance consisting of at least three components, method for producing said coating substance and use thereof BASF COATING AG (DE) 2005-09-20 US disclosed
EP-1135423-B1 COATING AGENT CONSISTING OF AT LEAST THREE COMPONENTS, METHOD FOR PRODUCING SAME AND ITS UTILISATION BASF COATINGS AG (DE) 2005-07-20 EP disclosed
EP-1183313-B1 AQUEOUS COATING MATERIAL AND MODULAR SYSTEM FOR PRODUCING SAME BASF COATINGS AG (DE) 2005-02-16 EP disclosed
EP-0740674-A1 POLYURETHANE RESINS, PROCESS FOR PRODUCING THEM AND THEIR USE IN WATER-DILUTABLE COATING AGENTS BASF Lacke und Farben AG (DE) 1996-11-06 EP disclosed
US-5502101-A Process for the production of a multicoat finish and aqueous basecoats suitable for this process BASF LACKE + FARBEN, AG (DE) 1996-03-26 US disclosed
WO-1995035348-A1 AT LEAST THREE-PART COATING AGENT, PROCESS FOR PRODUCING IT AND ITS USE BASF LACKE + FARBEN AG (DE) 1995-12-28 WO disclosed
WO-1995020001-A1 POLYURETHANE RESINS, PROCESS FOR PRODUCING THEM AND THEIR USE IN WATER-DILUTABLE COATING AGENTS BASF LACKE + FARBEN AG (DE) 1995-07-27 WO disclosed
EP-0661307-A2 Transparent resin and plastic lens HITACHI CHEMICAL CO., LTD. (JP) 1995-07-05 EP disclosed
EP-0302516-B1 Optical article made of amorphous thermoplastic polyester resin MITSUBISHI RAYON CO (JP) 1993-12-15 EP disclosed
US-4910291-A From aromatic diacid MITSUBISHI RAYON COMPANY LTD. (JP) 1990-03-20 US disclosed
EP-0302516-A2 Optical article made of amorphous thermoplastic polyester resin MITSUBISHI RAYON CO., LTD. (JP) 1989-02-08 EP disclosed
EP-0068804-A1 Process for producing substantially linear carbonate polymer PPG INDUSTRIES, INC. (US) 1983-01-05 EP disclosed
US-4365055-A Process for producing substantially linear carbonate polymer PPG INDUSTRIES, INC. (US) 1982-12-21 US disclosed