SCHEMBL28708772

SCHEMBL28708772

CCc1cccc(C(=O)c2cccc(CC)c2C)c1C

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 2/20 0.48
GABRB2 P47870 2/20 0.48
CLCN2 P51788 1/20 0.43
TSHR P16473 2/20 0.42
NLRP3 Q96P20 2/20 0.41
CDC25B P30305 1/20 0.41
HTT P42858 2/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2C9 P11712 1/20 0.39
KMT2A Q03164 1/20 0.39
HPGD P15428 1/20 0.38
MRGPRX4 Q96LA9 1/20 0.38
ALDH1A1 P00352 2/20 0.38
LMNA P02545 1/20 0.38
TP53 P04637 1/20 0.38
GAA P10253 1/20 0.38
MAPT P10636 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
HSD17B10 Q99714 1/20 0.37

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
SCHEMBL10580853 0.87 AKR1C3 (0.50) CLCN2KMT2AHPGDALDH1A1GAA
SCHEMBL31086202 0.87 AKR1C3 (0.50) CLCN2KMT2AHPGDALDH1A1GAA
SCHEMBL28642784 0.86 GABRA1 (0.39) GABRA1GABRB2CLCN2TSHRCDC25B
SCHEMBL622225 0.85 CLCN2 (0.54) GABRA1GABRB2CLCN2TSHRHTT
SCHEMBL13862488 0.85 GABRA1 (0.46) GABRA1GABRB2CLCN2TSHRNLRP3
Benzene SCHEMBL28861692 0.85 CLCN2 (0.54) GABRA1GABRB2CLCN2TSHRHTT
SCHEMBL1892417 0.83 GABRA1 (0.45) GABRA1GABRB2CLCN2TSHRNLRP3
SCHEMBL8093171 0.83 GABRA1 (0.45) GABRA1GABRB2CLCN2TSHRNLRP3
SCHEMBL1334610 0.83 PARP1 (0.47) GABRA1GABRB2CLCN2TSHRNLRP3
SCHEMBL16961430 0.83 GABRA1 (0.48) GABRA1GABRB2CLCN2TSHRNLRP3

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-107793991-B Copper-clad laminate for flexible printed wiring board, and flexible printed wiring board 荒川化学工业株式会社 2022-03-08 CN disclosed
CN-114144163-A Nail coatings based on photocurable compositions 阿科玛法国公司 2022-03-04 CN disclosed