SCHEMBL9502732

SCHEMBL9502732

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

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.56
ALDH1A1 P00352 4/20 0.41
TDP1 Q9NUW8 2/20 0.41
ACACB O00763 2/20 0.38
MAPK1 P28482 1/20 0.38
CYP2C19 P33261 1/20 0.34
ZDHHC20 Q5W0Z9 1/20 0.33
ZDHHC2 Q9UIJ5 1/20 0.33
TAAR1 Q96RJ0 1/20 0.31
TGM2 P21980 2/20 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
SCHEMBL24492174 1.00 TSHR (0.56) TSHRALDH1A1TDP1ACACBMAPK1
SCHEMBL8362687 0.83 TSHR (0.56) TSHRALDH1A1TDP1ACACBMAPK1
SCHEMBL1143770 0.81 TSHR (0.52) TSHRALDH1A1TDP1ACACBMAPK1
SCHEMBL19860715 0.80 TSHR (0.62) TSHRALDH1A1TDP1ACACBMAPK1
SCHEMBL21368145 0.80 TSHR (0.52) TSHRALDH1A1TDP1ACACBMAPK1
Acetone SCHEMBL28215913 0.79 TSHR (0.56) TSHRALDH1A1TDP1ACACBMAPK1
SCHEMBL10593260 0.78
SCHEMBL8401460 0.78
SCHEMBL319728 0.78
SCHEMBL1315706 0.78

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0271797-B1 SILVER HALIDE COLOR LIGHT SENSITIVE ELEMENTS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1993-05-26 EP disclosed
US-4990435-A Stable polymeric coating MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1991-02-05 US disclosed
EP-0226129-B1 SILVER HALIDE PHOTOGRAPHIC ELEMENT, PHOTOGRAPHIC COATING COMPOSITION AND PROCESS TO PREPARE AN AQUEOUS DISPERSION OF A HYDROPHOBIC COMPOUND MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1990-05-23 EP disclosed
US-4822728-A CONTROLLED SMEARING OF IMAGE-FORMING DYE MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1989-04-18 US disclosed
EP-0271797-A2 Silver halide color light sensitive elements MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1988-06-22 EP disclosed
US-4734095-A Self-centering artificial introaocular lens SIEPSER STEVEN B (US) 1988-03-29 US disclosed
EP-0226129-A2 Silver halide photographic element, photographic coating composition and process to prepare an aqueous dispersion of a hydrophobic compound MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1987-06-24 EP disclosed
US-4637467-A INJECTION OF N-3-OXOHYDROCARBON-SUBSTITUTED ACRYLAMIDES PHILLIPS PETROLEUM COMPANY (US) 1987-01-20 US disclosed
US-4332873-A Multilayer printing plates and process for making same HERCULES INCORPORATED (US) 1982-06-01 US disclosed
US-4266007-A Multilayer printing plates and process for making same HERCULES INCORPORATED (US) 1981-05-05 US disclosed
US-4168173-A UNSATURATED POLYESTERS, UNSATURATED MONOMER, BISPHENOL-EPICHLOROHYDRIN COPOLYMER THICKENER HERCULES INCORPORATED (US) 1979-09-18 US disclosed
US-3941836-A SOLUBILIZERS, PLASTICIZER, UV ABSORBER THE LUBRIZOL CORPORATION (US) 1976-03-02 US disclosed