SCHEMBL8833729

SCHEMBL8833729

COc1ccc(Nc2cc3c(cc2Nc2ccccc2)C(=O)NC3=O)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 7/20 1.00
SRC P12931 5/20 1.00
MAPT P10636 4/20 0.73
MEN1 O00255 4/20 0.73
KMT2A Q03164 4/20 0.73
PRKD3 O94806 3/20 0.73
PRKCG P05129 3/20 0.73
PRKCB P05771 3/20 0.73
PRKCA P17252 3/20 0.73
PRKCH P24723 3/20 0.73
PRKCI P41743 3/20 0.73
PRKCE Q02156 3/20 0.73
PRKCQ Q04759 3/20 0.73
PRKCZ Q05513 3/20 0.73
PRKCD Q05655 3/20 0.73
PRKD1 Q15139 3/20 0.73
MAPK1 P28482 3/20 0.73
TDP1 Q9NUW8 3/20 0.73
ALDH1A1 P00352 3/20 0.73
HPGD P15428 3/20 0.73

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
SCHEMBL5814108 0.94 EGFR (0.88) EGFRSRCMAPTMEN1KMT2A
SCHEMBL8834532 0.87 EGFR (0.76) EGFRSRCMAPTMEN1KMT2A
Daph SCHEMBL11017 0.86 EGFR (1.00) EGFRSRCMAPTMEN1KMT2A
SCHEMBL8834258 0.85 EGFR (0.73) EGFRSRCMAPTMEN1KMT2A
SCHEMBL8835073 0.84 EGFR (0.72) EGFRSRCMAPTMEN1KMT2A
SCHEMBL8833806 0.82 EGFR (0.69) EGFRSRCMAPTMEN1KMT2A
SCHEMBL8834907 0.80 EGFR (0.87) EGFRSRCMAPTMEN1KMT2A
SCHEMBL8834581 0.80 EGFR (0.66) EGFRSRCMAPTMEN1KMT2A
SCHEMBL8834140 0.80 EGFR (0.80) EGFRSRCMAPTMEN1KMT2A
SCHEMBL8834300 0.79 MAOA (0.66) EGFRSRCMAPTMEN1KMT2A

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
US-5663336-A IMIDATION OF DIAMINOPHTHALIC ACID TO FORM KINASE INHIBITORS AS ANTITUMOR AGENTS CIBA-GEIGY CORPORATION (US) 1997-09-02 US disclosed
US-5491144-A KINASE INHIBITORS, ANTITUMOR AGENTS CIBA-GEIGY CORPORATION (US) 1996-02-13 US disclosed
EP-0516588-B1 Substituted diaminophtalimides and analogues CIBA GEIGY AG (CH) 1994-07-13 EP disclosed
EP-0516588-A1 Substituted diaminophtalimides and analogues CIBA-GEIGY AG (CH) 1992-12-02 EP disclosed