SCHEMBL28511547

SCHEMBL28511547

Cc1ccc(NC(=O)C2(C(N)=O)CC2)cc1C

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.51
KMT2A Q03164 3/20 0.50
MEN1 O00255 2/20 0.50
NPSR1 Q6W5P4 1/20 0.50
USP2 O75604 1/20 0.49
ALOX15 P16050 1/20 0.49
CASP1 P29466 1/20 0.49
CASP7 P55210 1/20 0.49
HSD17B10 Q99714 1/20 0.49
F13A1 P00488 1/20 0.48
TGM2 P21980 1/20 0.48
GAA P10253 3/20 0.47
RAB9A P51151 6/20 0.47
NPC1 O15118 4/20 0.47
KDM4E B2RXH2 1/20 0.46
ALDH1A1 P00352 3/20 0.44
TSHR P16473 2/20 0.44
RECQL P46063 1/20 0.44
MAPT P10636 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44

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
SCHEMBL30555191 1.00 POLB (0.51) POLBKMT2AMEN1NPSR1USP2
SCHEMBL30074470 0.90 POLB (0.58) POLBKMT2AMEN1NPSR1GAA
SCHEMBL8238318 0.82 KIF11 (0.51) POLBRAB9ANPC1KDM4EALDH1A1
SCHEMBL13368505 0.82 NPC1 (0.51) POLBKMT2AMEN1NPSR1GAA
SCHEMBL30555190 0.79 CYP1A2 (0.46) POLBKMT2AMEN1NPSR1GAA
SCHEMBL20003938 0.79 POLB (0.45) POLBKMT2AMEN1NPSR1HSD17B10
SCHEMBL20003906 0.78 KDR (0.56) RAB9ANPC1SMN1; SMN2
SCHEMBL6715811 0.77 RAB9A (0.52) POLBKMT2AMEN1NPSR1USP2
SCHEMBL2056400 0.76 SPHK1 (0.53) POLBKMT2ANPSR1RAB9ANPC1
SCHEMBL6918008 0.76 POLB (0.66) POLBKMT2AMEN1USP2ALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112142619-B 1, 1-cyclopropane dicarboxylic acid amide compound and preparation method and application thereof 浙江工业大学 2023-01-10 CN disclosed
CN-112142619-A 1, 1-cyclopropane dicarboxylic acid amide compound and preparation method and application thereof 浙江工业大学 2020-12-29 CN disclosed