SCHEMBL4733403

SCHEMBL4733403

NS(=O)(=O)c1ccc(-c2ccccc2NC(=O)c2cccnc2Cl)cc1

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 1/20 0.74
▸ ALDH1A1 P00352 4/20 0.53
▸ HPGD P15428 2/20 0.53
▸ KDM4E B2RXH2 1/20 0.52
▸ RXFP1 Q9HBX9 1/20 0.52
▸ L3MBTL1 Q9Y468 1/20 0.52
▸ CA12 O43570 1/20 0.51
▸ CA1 P00915 1/20 0.51
▸ CA2 P00918 1/20 0.51
▸ CA9 Q16790 1/20 0.51
▸ HTT P42858 3/20 0.50
▸ SMN1; SMN2 Q16637 3/20 0.50
▸ GAA P10253 1/20 0.50
▸ MDM4 O15151 1/20 0.50
▸ MITF O75030 1/20 0.50
▸ MDM2 Q00987 1/20 0.50
▸ ATM Q13315 1/20 0.50
▸ GPR35 Q9HC97 1/20 0.50
▸ EGFR P00533 4/20 0.49
▸ KMT2A Q03164 2/20 0.48

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
SCHEMBL4730004 0.89 TDP1 (0.74) TDP1ALDH1A1HPGDKDM4ERXFP1
SCHEMBL4732493 0.88 TDP1 (0.64) TDP1ALDH1A1HPGDKDM4ERXFP1
Boscalid SCHEMBL29368300 0.86 TDP1 (1.00) TDP1ALDH1A1HPGDKDM4ERXFP1
Boscalid SCHEMBL29488452 0.86 TDP1 (1.00) TDP1ALDH1A1HPGDKDM4ERXFP1
Boscalid SCHEMBL18517 0.86 TDP1 (1.00) TDP1ALDH1A1HPGDKDM4ERXFP1
SCHEMBL8074225 0.85 TDP1 (0.85) TDP1ALDH1A1HPGDKDM4ERXFP1
Boscalid SCHEMBL3619333 0.84 TDP1 (0.97) TDP1ALDH1A1HPGDKDM4ERXFP1
Boscalid SCHEMBL6847778 0.84 TDP1 (0.97) TDP1ALDH1A1HPGDKDM4ERXFP1
Boscalid SCHEMBL8321645 0.84 TDP1 (0.97) TDP1ALDH1A1HPGDKDM4ERXFP1
Boscalid SCHEMBL3981357 0.84 TDP1 (0.97) TDP1ALDH1A1HPGDKDM4ERXFP1

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
WO-2008053044-A2 HETARYL CARBON ACID-N-(BIPHEN-2-YL)AMIDE COMPOUNDS BASF SE (DE) 2008-05-08 — — WO claimed
WO-2008053044-A2 HETARYL CARBON ACID-N-(BIPHEN-2-YL)AMIDE COMPOUNDS BASF SE (DE) 2008-05-08 — — WO disclosed
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