SCHEMBL11718990

SCHEMBL11718990

CC(=O)Nc1c2c(c3ccccc3c1Cl)C(=O)NC2=O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 6/20 0.46
▸ ALDH1A1 P00352 2/20 0.46
▸ GAA P10253 1/20 0.46
▸ HPGD P15428 1/20 0.46
▸ HSD17B10 Q99714 1/20 0.46
▸ POLB P06746 3/20 0.43
▸ MAPT P10636 3/20 0.43
▸ TSHR P16473 1/20 0.43
▸ MEN1 O00255 2/20 0.41
▸ KMT2A Q03164 2/20 0.41
▸ CYP1A2 P05177 1/20 0.41
▸ CYP2C9 P11712 1/20 0.41
▸ IDO1 P14902 1/20 0.41
▸ CASP3 P42574 1/20 0.40
▸ SIRT2 Q8IXJ6 1/20 0.40
▸ HSP90AA1 P07900 1/20 0.38
▸ HSP90AB1 P08238 1/20 0.38
▸ GSK3A P49840 2/20 0.37
▸ GSK3B P49841 2/20 0.37
▸ CDK5 Q00535 2/20 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
SCHEMBL11712294 0.85 KDM4E (0.41) KDM4EALDH1A1GAAHPGDHSD17B10
SCHEMBL11713467 0.84 KDM4E (0.55) KDM4EALDH1A1GAAHPGDHSD17B10
SCHEMBL11711407 0.83 CASP3 (0.51) KDM4EALDH1A1HPGDPOLBMAPT
SCHEMBL11720863 0.83 ALDH1A1 (0.48) KDM4EALDH1A1GAAHPGDHSD17B10
SCHEMBL11720175 0.83 CASP3 (0.45) ALDH1A1MEN1KMT2ACYP1A2CYP2C9
SCHEMBL11708220 0.82 KDM4E (0.46) KDM4EALDH1A1GAAHPGDHSD17B10
SCHEMBL11710437 0.82 PARP1 (0.48) KDM4EALDH1A1GAAPOLBMAPT
SCHEMBL11712171 0.80 KDM4E (0.64) KDM4EALDH1A1GAAHPGDHSD17B10
SCHEMBL11715038 0.74 PRKCB (0.47) KDM4EALDH1A1GAAHPGDMAPT
SCHEMBL11714771 0.72 ALDH1A1 (0.54) KDM4EALDH1A1GAAHPGDHSD17B10

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-4055565-A Optical brightening agents of naphthalimide derivatives SUMITOMO CHEMICAL COMPANY, LIMITED (JA) 1977-10-25 — — US disclosed
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