SCHEMBL24501092

SCHEMBL24501092

CCOC(=O)c1c(-c2ccc(Cl)c(Cl)c2)n(C)c(C)c(-c2ccc(Cl)cc2)c1=O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA2 P47869 2/20 0.47
GABRB2 P47870 2/20 0.47
TP53 P04637 1/20 0.45
MDM2 Q00987 1/20 0.45
ALDH1A1 P00352 3/20 0.44
KDM4E B2RXH2 2/20 0.44
HPGD P15428 2/20 0.44
TSHR P16473 2/20 0.44
AR P10275 1/20 0.44
ALOX15 P16050 1/20 0.44
CASP1 P29466 1/20 0.44
HSD17B10 Q99714 1/20 0.44
TEAD2 Q15562 1/20 0.43
ALOX5 P09917 3/20 0.43
PRKCZ Q05513 2/20 0.42
KMT2A Q03164 2/20 0.42
MEN1 O00255 1/20 0.42
PTGES O14684 1/20 0.41
APAF1 O14727 1/20 0.41
SMAD3 P84022 1/20 0.41

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
SCHEMBL29830601 1.00 GABRA2 (0.47) GABRA2GABRB2TP53MDM2ALDH1A1
SCHEMBL24500641 0.90 TSHR (0.43) GABRA2GABRB2ALDH1A1KDM4EHPGD
SCHEMBL31678415 0.90 TSHR (0.43) GABRA2GABRB2ALDH1A1KDM4EHPGD
SCHEMBL31678221 0.88 ALDH1A1 (0.42) GABRA2GABRB2ALDH1A1KDM4EHPGD
SCHEMBL24501182 0.88 ALDH1A1 (0.42) GABRA2GABRB2ALDH1A1KDM4EHPGD
SCHEMBL24501091 0.85 POLB (0.41) TP53ALDH1A1KDM4EHPGDHSD17B10
SCHEMBL29830842 0.85 POLB (0.41) TP53ALDH1A1KDM4EHPGDHSD17B10
SCHEMBL10463694 0.84 AR (0.57) GABRA2GABRB2TP53MDM2ALDH1A1
SCHEMBL31678341 0.83 APAF1 (0.41) GABRA2GABRB2ALDH1A1KDM4EHPGD
SCHEMBL24500632 0.83 APAF1 (0.41) GABRA2GABRB2ALDH1A1KDM4EHPGD

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-116547273-A Herbicidal derivatives 先正达农作物保护股份公司 2023-08-04 CN disclosed
WO-2022117445-A1 HERBICIDAL DERIVATIVES SYNGENTA CROP PROTECTION AG (CH) 2022-06-09 WO disclosed