SCHEMBL7867160

SCHEMBL7867160

COc1cc2c(Nc3ccc(Br)cc3F)ncnc2cc1OCCCN1CCOCC1

nearest known ligand 0.83

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 13/20 0.83
EGFR P00533 11/20 0.83
FGFR1 P11362 8/20 0.83
FLT1 P17948 8/20 0.83
FLT4 P35916 7/20 0.83
SRC P12931 7/20 0.74
RET P07949 3/20 0.70
CIT O14578 1/20 0.70
GAK O14976 1/20 0.70
EPHB6 O15197 1/20 0.70
ABCC4 O15439 1/20 0.70
DAPK3 O43293 1/20 0.70
RIPK2 O43353 1/20 0.70
NR1I2 O75469 1/20 0.70
RPS6KA4 O75676 1/20 0.70
STK17B O94768 1/20 0.70
STK10 O94804 1/20 0.70
PRKD3 O94806 1/20 0.70
ABCB11 O95342 1/20 0.70
MAP4K4 O95819 1/20 0.70

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 SCHEMBL7866060 0.99 KDR (0.84) KDREGFRFGFR1FLT1FLT4
SCHEMBL7859476 0.96 KDR (0.83) KDREGFRFGFR1FLT1FLT4
Hydrochloric Acid SCHEMBL7870588 0.95 EGFR (0.81) KDREGFRFGFR1FLT1FLT4
Hydrochloric Acid SCHEMBL1468245 0.94 KDR (0.83) KDREGFRFGFR1FLT1FLT4
SCHEMBL11517 0.92 KDR (0.84) KDREGFRFGFR1FLT1FLT4
SCHEMBL17520359 0.92 KDR (0.87) KDREGFRFGFR1FLT1FLT4
SCHEMBL17520326 0.91 EGFR (0.85) KDREGFRFGFR1FLT1FLT4
SCHEMBL7857964 0.91 KDR (1.00) KDREGFRFGFR1FLT1FLT4
Hydrochloric Acid SCHEMBL27218174 0.91 EGFR (1.00) KDREGFRFGFR1FLT1FLT4
SCHEMBL22997455 0.90 KDR (0.81) KDREGFRFGFR1FLT1FLT4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0885198-B1 4-ANILINOQUINAZOLINE DERIVATIVES ASTRAZENECA AB (SE) 2001-12-19 EP claimed
EP-0885198-A1 4-ANILINOQUINAZOLINE DERIVATIVES ZENECA LIMITED (GB) 1998-12-23 EP claimed
WO-1997032856-A1 4-ANILINOQUINAZOLINE DERIVATIVES ZENECA LIMITED (GB) 1997-09-12 WO claimed
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
EP-0885198-A1 4-ANILINOQUINAZOLINE DERIVATIVES ZENECA LIMITED (GB) 1998-12-23 EP disclosed
WO-1997032856-A1 4-ANILINOQUINAZOLINE DERIVATIVES ZENECA LIMITED (GB) 1997-09-12 WO disclosed