SCHEMBL9358514

SCHEMBL9358514

Cc1ccc([N+](=O)[O-])cc1Nc1ccc(C(F)(F)F)cn1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.50
▸ TEAD1 P28347 1/20 0.50
▸ MEN1 O00255 5/20 0.49
▸ KMT2A Q03164 5/20 0.49
▸ MAPT P10636 7/20 0.47
▸ HTT P42858 2/20 0.46
▸ HPGD P15428 1/20 0.46
▸ RAB9A P51151 3/20 0.45
▸ NPSR1 Q6W5P4 1/20 0.45
▸ PKM P14618 1/20 0.44
▸ GAA P10253 1/20 0.44
▸ SMN1; SMN2 Q16637 2/20 0.43
▸ ALOX12 P18054 1/20 0.43
▸ DYRK3 O43781 1/20 0.42
▸ ABL1 P00519 1/20 0.42
▸ CDK1 P06493 1/20 0.42
▸ CSF1R P07333 1/20 0.42
▸ MET P08581 1/20 0.42
▸ PDGFRB P09619 1/20 0.42
▸ PHKG2 P15735 1/20 0.42

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
SCHEMBL10582677 0.86 MAPT (0.57) ALDH1A1MEN1KMT2AMAPTHTT
SCHEMBL10585355 0.85 MEN1 (0.47) MEN1KMT2AMAPTRAB9ANPSR1
SCHEMBL24497413 0.83 MAPT (0.47) ALDH1A1TEAD1MEN1KMT2AMAPT
SCHEMBL10586422 0.80 FGFR4 (0.56) ALDH1A1MEN1KMT2AMAPTHTT
SCHEMBL22719743 0.78 TEAD1 (0.60) TEAD1MAPTGAAKDR
SCHEMBL9358482 0.78 TEAD1 (0.55) TEAD1MAPTGAAABL1KDR
SCHEMBL10582412 0.78 MEN1 (0.60) ALDH1A1MEN1KMT2AMAPTRAB9A
SCHEMBL25314807 0.77 MEN1 (0.51) ALDH1A1MEN1KMT2AMAPTRAB9A
SCHEMBL22719666 0.75 TEAD1 (0.52) ALDH1A1TEAD1MEN1KMT2AMAPT
SCHEMBL29505063 0.75 TEAD1 (0.52) ALDH1A1TEAD1MEN1KMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0320448-A2 3-Aminobenzoyl phenyl urea CIBA-GEIGY AG (CH) 1989-06-14 — — EP claimed
EP-0320448-B1 3-Aminobenzoyl phenyl urea CIBA GEIGY AG (CH) 1994-12-28 — — EP disclosed
US-4946854-A PESTICIDES CIBA-GEIGY CORPORATION (US) 1990-08-07 — — US disclosed
EP-0320448-A2 3-Aminobenzoyl phenyl urea CIBA-GEIGY AG (CH) 1989-06-14 — — EP disclosed
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