SCHEMBL7867152

SCHEMBL7867152

COc1cc2c(Nc3ccc(Cl)cc3F)ncnc2cc1OCCCN1CCN(C)CC1

nearest known ligand 0.98

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDR P35968 17/20 0.98
FGFR1 P11362 15/20 0.98
FLT1 P17948 15/20 0.98
EGFR P00533 14/20 0.98
FLT4 P35916 12/20 0.98
AURKA O14965 3/20 0.77
PDGFRB P09619 3/20 0.77
TEK Q02763 3/20 0.77
AURKB Q96GD4 3/20 0.77
EPHB2 P29323 1/20 0.71
ERBB2 P04626 1/20 0.71

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
Hydrochloric Acid SCHEMBL7864665 0.99 KDR (1.00) KDRFGFR1FLT1EGFRFLT4
SCHEMBL7864669 0.96 KDR (1.00) KDRFGFR1FLT1EGFRFLT4
SCHEMBL1467998 0.94 KDR (0.90) KDRFGFR1FLT1EGFRFLT4
SCHEMBL1468087 0.94 FGFR1 (0.98) KDRFGFR1FLT1EGFRFLT4
Hydrochloric Acid SCHEMBL1468148 0.93 KDR (0.89) KDRFGFR1FLT1EGFRFLT4
Hydrochloric Acid SCHEMBL27218199 0.93 FGFR1 (1.00) KDRFGFR1FLT1EGFRFLT4
Hydrochloric Acid SCHEMBL1467744 0.92 FGFR1 (0.98) KDRFGFR1FLT1EGFRFLT4
SCHEMBL7857964 0.92 KDR (1.00) KDRFGFR1FLT1EGFRFLT4
Hydrochloric Acid SCHEMBL7870593 0.91 KDR (0.98) KDRFGFR1FLT1EGFRFLT4
Hydrochloric Acid SCHEMBL27218174 0.90 EGFR (1.00) KDRFGFR1FLT1EGFRFLT4

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
EP-0885198-B1 4-ANILINOQUINAZOLINE DERIVATIVES ASTRAZENECA AB (SE) 2001-12-19 EP disclosed
US-6291455-B1 PRODUCING AN ANTIANGIOGENIC AND/OR VASCULAR PERMEABILITY REDUCING EFFECT ZENECA LIMITED (GB) 2001-09-18 US disclosed