SCHEMBL11082174

SCHEMBL11082174

Cc1c(Cl)ccc(OC(C)C(=O)Nc2ccc(N)cc2)c1Cl

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.53
KDM4E B2RXH2 1/20 0.53
GAA P10253 1/20 0.53
LMNA P02545 2/20 0.49
TSHR P16473 1/20 0.49
MAPK1 P28482 1/20 0.49
L3MBTL1 Q9Y468 3/20 0.47
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
HTT P42858 1/20 0.47
PKM P14618 1/20 0.45
MAPT P10636 3/20 0.44
HPGD P15428 2/20 0.44
NPSR1 Q6W5P4 1/20 0.43
POLB P06746 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
SCHEMBL11079681 0.90 ALDH1A1 (0.62) ALDH1A1KDM4EGAALMNATSHR
SCHEMBL11082625 0.90 ALDH1A1 (0.55) ALDH1A1KDM4EGAALMNATSHR
SCHEMBL11081961 0.89 ALDH1A1 (0.67) ALDH1A1KDM4EGAALMNATSHR
SCHEMBL11080607 0.89 NPSR1 (0.56) ALDH1A1KDM4EGAALMNATSHR
SCHEMBL11072083 0.88 L3MBTL1 (0.55) ALDH1A1KDM4EGAALMNATSHR
SCHEMBL55118 0.87 KDM4E (0.52) ALDH1A1KDM4EGAALMNATSHR
SCHEMBL7654105 0.87 KDM4E (0.52) ALDH1A1KDM4EGAALMNATSHR
SCHEMBL3062871 0.87 KDM4E (0.52) ALDH1A1KDM4EGAALMNATSHR
SCHEMBL5482698 0.87 KDM4E (0.52) ALDH1A1KDM4EGAALMNATSHR
SCHEMBL11074811 0.86 MEN1 (0.55) ALDH1A1KDM4EGAALMNATSHR

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-4465507-A Herbicidal acetanilides MITSUBISHI PETROCHEMICAL CO., LTD. (JP) 1984-08-14 US disclosed