SCHEMBL8883646

SCHEMBL8883646

Nc1ccc(Cl)cc1Nc1cccc(Cl)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FADS1 O60427 5/20 0.53
MAPT P10636 3/20 0.47
GAA P10253 2/20 0.47
HTR3E A5X5Y0 1/20 0.47
HTR3B O95264 1/20 0.47
HTR3A P46098 1/20 0.47
ROCK1 Q13464 1/20 0.47
HTR3D Q70Z44 1/20 0.47
HTR3C Q8WXA8 1/20 0.47
HPGD P15428 1/20 0.45
EGFR P00533 4/20 0.43
ABL1 P00519 1/20 0.43
SRC P12931 1/20 0.43
PRKCA P17252 1/20 0.43
ALDH1A1 P00352 3/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
CYP3A4 P08684 1/20 0.43
ALOX15 P16050 1/20 0.43
TSHR P16473 1/20 0.43
TDP1 Q9NUW8 1/20 0.43

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
SCHEMBL4925570 0.87 MAPT (0.59) FADS1MAPTGAAHPGDALDH1A1
SCHEMBL11741492 0.86 NPSR1 (0.49) FADS1MAPTGAAEGFRABL1
SCHEMBL11738231 0.85 FADS1 (0.53) FADS1MAPTGAAHTR3EHTR3B
SCHEMBL4054374 0.85 MAPT (0.62) FADS1MAPTGAAHTR3EHTR3B
SCHEMBL4929938 0.82 EGFR (0.53) MAPTGAAROCK1HPGDEGFR
SCHEMBL4930598 0.82 CYP3A4 (0.48) MAPTGAAHPGDALDH1A1SMN1; SMN2
SCHEMBL31495027 0.80 PTGS1 (0.51) ALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL31723253 0.80 FADS1 (0.47) FADS1MAPTGAAHTR3EHTR3B
SCHEMBL22231930 0.80 FADS1 (0.47) FADS1MAPTGAAHTR3EHTR3B
SCHEMBL29454190 0.80 FADS1 (0.47) FADS1MAPTGAAHTR3EHTR3B

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5661169-A HAVE AFFINITY FOR VASOPRESSIN AND/OR OXYTOCIN RECEPTORS SANOFI (FR) 1997-08-26 US disclosed
US-5585394-A INHIBITOR, ANTAGONIST OF VASOPRESSIN OR OXYTOCIN SANOFI (FR) 1996-12-17 US disclosed
EP-0694536-A1 1-Benzyl-1,3-dihydro-2H-benzimidazol-2-one derivatives, their preparation and pharmaceutical compositions containing them SANOFI (FR) 1996-01-31 EP disclosed
CN-1106804-A 1-Benzenesulfonyl-1,3-dihydro-2H-benzimidazol-2-one derivatives SANOFI SA (FR) 1995-08-16 CN disclosed
EP-0636614-A1 Derivatives of 1-benzenesulfonyl-1,3-dihydro-2H-benzimidazol-2-one, their preparation and pharmaceutical compositions containing them SANOFI (FR) 1995-02-01 EP disclosed