SCHEMBL27686261

SCHEMBL27686261

NC(=O)c1cc2c(Nc3ccc(F)c(Cl)c3)ncnc2cc1OCC(F)(F)F

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 16/20 0.60
FBP1 P09467 2/20 0.59
ERBB2 P04626 5/20 0.58
AURKA O14965 2/20 0.58
KDR P35968 2/20 0.58
INSR P06213 1/20 0.58
PDGFRB P09619 1/20 0.58
FLT4 P35916 1/20 0.58
CLK1 P49759 1/20 0.58
EPHB4 P54760 1/20 0.58
TEK Q02763 1/20 0.58
AURKB Q96GD4 1/20 0.58
RPS6KB1 P23443 1/20 0.57
ERBB4 Q15303 1/20 0.56
HDAC3 O15379 2/20 0.55
HDAC4 P56524 2/20 0.55
HDAC1 Q13547 2/20 0.55
HDAC7 Q8WUI4 2/20 0.55
HDAC2 Q92769 2/20 0.55
HDAC10 Q969S8 2/20 0.55

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
SCHEMBL27686218 0.89 EGFR (0.60) EGFRFBP1ERBB2AURKAKDR
SCHEMBL6129182 0.87 EGFR (0.75) EGFRFBP1ERBB2AURKAKDR
Water SCHEMBL28549001 0.86 EGFR (0.74) EGFRFBP1ERBB2AURKAKDR
SCHEMBL2979125 0.85 FBP1 (0.64) EGFRFBP1ERBB2AURKAKDR
SCHEMBL27667251 0.84 EGFR (0.62) EGFRFBP1ERBB2AURKAKDR
SCHEMBL27686224 0.84 EGFR (0.59) EGFRFBP1ERBB2AURKAKDR
SCHEMBL16212227 0.81 FBP1 (0.59) EGFRFBP1ERBB2AURKAKDR
SCHEMBL27686240 0.80 EGFR (0.63) EGFRFBP1ERBB2AURKAKDR
SCHEMBL27860183 0.79 EGFR (0.63) EGFRFBP1ERBB2AURKAKDR
SCHEMBL17498549 0.79 EGFR (0.78) EGFRERBB2ERBB4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1972688-A 4-phenylamino-quinazolin-6-yl-amides WARNER LAMBERT CO (US) 2007-05-30 CN claimed
CN-1972688-B 4-phenylamino-quinazolin-6-yl-amides WARNER LAMBERT CO 2012-06-27 CN disclosed
CN-1972688-A 4-phenylamino-quinazolin-6-yl-amides WARNER LAMBERT CO (US) 2007-05-30 CN disclosed