SCHEMBL7848549

SCHEMBL7848549

COc1cc2c(Oc3ccc4c(c3)CC(C(=O)OC(C)(C)C)N4)ncnc2cc1OC(C)C1CCNCC1

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ RAF1 P04049 2/20 0.42
▸ KDR P35968 12/20 0.41
▸ AURKA O14965 2/20 0.41
▸ MET P08581 2/20 0.41
▸ TEK Q02763 2/20 0.41
▸ AURKB Q96GD4 2/20 0.41
▸ RET P07949 1/20 0.41
▸ KIF5B P33176 1/20 0.41
▸ PDGFRA P16234 3/20 0.41
▸ KIT P10721 1/20 0.41
▸ BRAF P15056 5/20 0.41
▸ CSF1R P07333 1/20 0.40

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
SCHEMBL7846902 0.76 KDR (0.45) RAF1KDRAURKAMETTEK
SCHEMBL7847135 0.75 KDR (0.45) KDRAURKAMETTEKAURKB
SCHEMBL6366468 0.74 KDR (0.43) KDRAURKAMETTEKAURKB
SCHEMBL7848154 0.74 KDR (0.43) RAF1KDRAURKAMETTEK
SCHEMBL7847654 0.74 KDR (0.44) RAF1KDRAURKAMETTEK
SCHEMBL7845204 0.73 KDR (0.45) RAF1KDRAURKAMETTEK
SCHEMBL7885975 0.72 KDR (0.41) KDRAURKAMETTEKAURKB
SCHEMBL7854726 0.69 KDR (0.42) KDRAURKAMETTEKAURKB
SCHEMBL5682902 0.69 KDR (0.46) KDRMETTEKAURKBRET
SCHEMBL6774386 0.68 KDM4E (0.46) KDRRET

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-1154774-A1 QUINAZOLINE DERIVATIVES AS ANGIOGENESIS INHIBITORS AstraZeneca AB (SE) 2001-11-21 — — EP disclosed
WO-2000047212-A1 QUINAZOLINE DERIVATIVES AS ANGIOGENESIS INHIBITORS ASTRAZENECA AB (SE) 2000-08-17 — — WO disclosed
Send feedback