SCHEMBL8833940

SCHEMBL8833940

COc1ccc(Nc2cc3c(cc2Nc2ccc(OC)cc2OC)C(=O)NC3=O)c(OC)c1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
STK10 O94804 2/20 0.61
SLK Q9H2G2 2/20 0.61
EGFR P00533 3/20 0.59
SRC P12931 2/20 0.59
GAA P10253 2/20 0.48
ALDH1A1 P00352 6/20 0.48
HPGD P15428 2/20 0.46
MAPT P10636 4/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
MAPK1 P28482 3/20 0.45
CYP3A4 P08684 2/20 0.45
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
KDM4E B2RXH2 1/20 0.45
RGS12 O14924 1/20 0.45
GMNN O75496 1/20 0.45
PRKD3 O94806 1/20 0.45
LMNA P02545 1/20 0.45
PRKCG P05129 1/20 0.45
PRKCB P05771 1/20 0.45

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
SCHEMBL8834532 0.91 EGFR (0.76) STK10SLKEGFRSRCGAA
SCHEMBL8834725 0.81 STK10 (0.61) STK10SLKEGFRSRCGAA
SCHEMBL5814108 0.80 EGFR (0.88) STK10SLKEGFRSRCGAA
SCHEMBL8835073 0.76 EGFR (0.72) STK10SLKEGFRSRCGAA
SCHEMBL8833729 0.75 EGFR (1.00) STK10SLKEGFRSRCGAA
SCHEMBL383690 0.75 MAOA (0.59) EGFRSRCALDH1A1MEN1KMT2A
SCHEMBL8834581 0.74 EGFR (0.66) STK10SLKEGFRSRCALDH1A1
SCHEMBL8833563 0.74 EGFR (0.61) STK10SLKEGFRSRCALDH1A1
SCHEMBL8833701 0.74 GAA (0.62) GAAALDH1A1HPGDMAPTSMN1; SMN2
SCHEMBL8834053 0.74 AKR1C3 (0.63) GAAALDH1A1HPGDMAPTSMN1; SMN2

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
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