SCHEMBL9413538

SCHEMBL9413538

O=c1[nH][nH]c(=O)c2cc(Nc3ccccc3)c(Nc3ccccc3)cc12

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BRAF P15056 6/20 0.76
▸ MAPT P10636 6/20 0.56
▸ ALDH1A1 P00352 6/20 0.56
▸ KDM4E B2RXH2 4/20 0.56
▸ MEN1 O00255 4/20 0.56
▸ KMT2A Q03164 4/20 0.56
▸ HPGD P15428 3/20 0.56
▸ TDP1 Q9NUW8 3/20 0.56
▸ GLA P06280 2/20 0.56
▸ EGFR P00533 2/20 0.56
▸ SRC P12931 2/20 0.56
▸ CYP3A4 P08684 2/20 0.56
▸ MAPK1 P28482 2/20 0.56
▸ LMNA P02545 2/20 0.56
▸ RGS12 O14924 1/20 0.56
▸ GMNN O75496 1/20 0.56
▸ PRKD3 O94806 1/20 0.56
▸ PRKCG P05129 1/20 0.56
▸ PRKCB P05771 1/20 0.56
▸ PRKCA P17252 1/20 0.56

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
SCHEMBL9413540 0.81 EGFR (0.59) BRAFMAPTALDH1A1KDM4EMEN1
SCHEMBL7072330 0.81 BRAF (0.58) BRAFMAPTALDH1A1KDM4EMEN1
SCHEMBL9413535 0.81 EGFR (0.59) BRAFMAPTALDH1A1KDM4EMEN1
SCHEMBL5080930 0.75 HSD17B10 (0.65) MAPTALDH1A1KDM4EMEN1KMT2A
SCHEMBL9413534 0.73 MAPT (0.49) BRAFMAPTALDH1A1KDM4EMEN1
SCHEMBL2459339 0.73 ALDH1A1 (0.51) BRAFMAPTALDH1A1KDM4EMEN1
Daph SCHEMBL11017 0.72 EGFR (1.00) BRAFMAPTALDH1A1KDM4EMEN1
SCHEMBL22923206 0.70 MEN1 (0.67) BRAFMAPTALDH1A1KDM4EMEN1
SCHEMBL8834218 0.69 TDP1 (0.69) BRAFMAPTALDH1A1KDM4EMEN1
SCHEMBL9381294 0.69 APP (0.70) BRAFMAPTALDH1A1KDM4EMEN1

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-0600831-A1 Phtalazinon derivatives CIBA-GEIGY AG (CH) 1994-06-08 — — EP claimed
JP-6228108-A — — None — — JP disclosed
JP-H06228108-A PHTHALAZINONE DERIVATIVE CIBA GEIGY AG 1994-08-16 — — JP disclosed
EP-0600831-A1 Phtalazinon derivatives CIBA-GEIGY AG (CH) 1994-06-08 — — EP disclosed
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