SCHEMBL7991171

SCHEMBL7991171

CCOc1cc2c(Nc3ccc(C)c(O[Si](c4ccccc4)(c4ccccc4)C(C)(C)C)c3)ncnc2cc1O

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
EGFR P00533 9/20 0.50
ERBB2 P04626 2/20 0.50
ERBB4 Q15303 2/20 0.50
KDR P35968 4/20 0.49
RET P07949 2/20 0.49
KIF5B P33176 2/20 0.49
FBP1 P09467 5/20 0.48
AURKA O14965 2/20 0.47
AURKB Q96GD4 2/20 0.47
LCK P06239 2/20 0.46

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
SCHEMBL7867169 0.91 KDR (0.58) EGFRKDRRETKIF5BAURKA
SCHEMBL13604740 0.81 EGFR (0.66) EGFRERBB2ERBB4KDRRET
Hydrochloric Acid SCHEMBL8707248 0.80 EGFR (0.55) EGFRERBB2ERBB4KDRRET
SCHEMBL14979614 0.72 EGFR (0.71) EGFRERBB2ERBB4KDRRET
SCHEMBL7452247 0.71 MAPK14 (0.58) EGFRKDRRETKIF5B
SCHEMBL4477758 0.71 EGFR (0.77) EGFRERBB2ERBB4KDRRET
SCHEMBL14388116 0.71 FBP1 (0.59) EGFRERBB2ERBB4KDRRET
Hydrochloric Acid SCHEMBL8808763 0.71 EGFR (0.77) EGFRERBB2ERBB4KDRRET
Hydrochloric Acid SCHEMBL8811939 0.71 EGFR (0.71) EGFRERBB2ERBB4KDRRET
SCHEMBL7973114 0.70 KDR (0.59) EGFRERBB2KDRRETKIF5B

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-6291455-B1 PRODUCING AN ANTIANGIOGENIC AND/OR VASCULAR PERMEABILITY REDUCING EFFECT ZENECA LIMITED (GB) 2001-09-18 US disclosed