SCHEMBL25969152

SCHEMBL25969152

CC#Cc1cccc(N(C(C)=O)C(C)=O)c1

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CRHBP P24387 1/20 0.46
CRHR2 Q13324 1/20 0.46
GAA P10253 1/20 0.39
HAO1 Q9UJM8 1/20 0.37
PARP1 P09874 1/20 0.35
CYP1A1 P04798 2/20 0.34
CYP1A2 P05177 2/20 0.34
CYP1B1 Q16678 2/20 0.34
FFAR1 O14842 5/20 0.34
NPSR1 Q6W5P4 2/20 0.33
POLB P06746 1/20 0.33
HSD17B10 Q99714 1/20 0.33
ACACB O00763 1/20 0.32
PTPN11 Q06124 1/20 0.32
PTGDR2 Q9Y5Y4 1/20 0.32
KCNN4 O15554 1/20 0.31
KCNA5 P22460 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
SCHEMBL25969163 0.86 CRHBP (0.54) CRHBPCRHR2FFAR1NPSR1ACACB
SCHEMBL25721548 0.81 CRHBP (0.47) CRHBPCRHR2GAAHAO1FFAR1
SCHEMBL10398568 0.79 CRHBP (0.65) CRHBPCRHR2GAANPSR1POLB
SCHEMBL22671358 0.79 HAO1 (0.36) HAO1PARP1FFAR1ACACBPTGDR2
SCHEMBL13232575 0.76 ALDH1A1 (0.47) CRHBPCRHR2GAACYP1A1CYP1A2
SCHEMBL7919787 0.74 CRHBP (0.51) CRHBPCRHR2GAANPSR1POLB
SCHEMBL12724811 0.73 ACACB (0.50) HAO1ACACB
SCHEMBL2876029 0.72 CYP1A1 (0.48) HAO1PARP1CYP1A1CYP1A2CYP1B1
SCHEMBL8374423 0.72 ALDH1A1 (0.57) CRHBPCRHR2GAAPARP1CYP1A2
SCHEMBL9998812 0.72 CRHBP (0.53) CRHBPCRHR2GAAPARP1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230260787-A1 COMPOSITION FOR FORMING PROTECTIVE FILM AGAINST ALKALINE AQUEOUS HYDROGEN PEROXIDE, SUBSTRATE FOR PRODUCING SEMICONDUCTOR APPARATUS, METHOD FOR FORMING PROTECTIVE FILM, AND METHOD FOR FORMING PATTERN SHIN-ETSU CHEMICAL CO., LTD. (JP) 2023-08-17 US disclosed