SCHEMBL10967652

SCHEMBL10967652

CCOC(=O)C(=CNc1ncnc2ccc(Oc3ccccc3)cc12)C(=O)OCC

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 7/20 0.53
ERBB2 P04626 6/20 0.53
MAPT P10636 2/20 0.49
CYP1A2 P05177 1/20 0.49
CYP3A4 P08684 1/20 0.49
CYP2D6 P10635 1/20 0.49
MAPK1 P28482 1/20 0.49
CYP2C19 P33261 1/20 0.49
RAB9A P51151 3/20 0.46
KMT2A Q03164 3/20 0.46
NPC1 O15118 2/20 0.46
CASP3 P42574 2/20 0.46
SENP8 Q96LD8 2/20 0.46
SENP7 Q9BQF6 2/20 0.46
SENP6 Q9GZR1 2/20 0.46
DHODH Q02127 2/20 0.46
GAA P10253 2/20 0.45
LMNA P02545 1/20 0.44
STAT1 P42224 1/20 0.44
ERBB4 Q15303 2/20 0.44

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
SCHEMBL11109791 0.86 EGFR (0.53) EGFRERBB2KMT2AERBB4KDR
SCHEMBL10969276 0.84 KDM4E (0.57) EGFRERBB2MAPTCYP1A2CYP3A4
SCHEMBL10967972 0.84 RAB9A (0.59) EGFRERBB2MAPTCYP1A2CYP3A4
SCHEMBL10971593 0.82 EGFR (0.52) EGFRERBB2MAPTCYP1A2CYP3A4
SCHEMBL10970783 0.82 CYP1A2 (0.51) EGFRERBB2MAPTCYP1A2CYP3A4
SCHEMBL10970750 0.80 EGFR (0.51) EGFRERBB2MAPTCYP1A2CYP3A4
SCHEMBL10972874 0.80 CYP1A2 (0.49) EGFRERBB2MAPTCYP1A2CYP3A4
SCHEMBL10966973 0.79 EGFR (0.50) EGFRERBB2MAPTCYP1A2CYP3A4
SCHEMBL10967368 0.79 KDM4E (0.53) EGFRERBB2MAPTCYP1A2CYP3A4
SCHEMBL10972059 0.78 EGFR (0.50) EGFRERBB2MAPTCYP1A2CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4543356-A Quinazoline derivatives FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1985-09-24 US disclosed