SCHEMBL1571511

SCHEMBL1571511

CC(COc1cc(Nc2ncc3cc(Br)ccc3n2)cc(-c2cnn(C)c2)c1)NC(=O)O

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ ACACB O00763 1/20 0.40
▸ DDR2 Q16832 10/20 0.38
▸ MAP4K3 Q8IVH8 1/20 0.38
▸ MAP4K1 Q92918 1/20 0.38
▸ BRAF P15056 7/20 0.37
▸ MAPK1 P28482 1/20 0.36

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
SCHEMBL1571239 0.90 GSK3B (0.41) ACACBDDR2MAP4K3MAP4K1BRAF
SCHEMBL1571237 0.90 GSK3B (0.41) ACACBDDR2MAP4K3MAP4K1BRAF
SCHEMBL1571306 0.90 GSK3B (0.41) ACACBDDR2MAP4K3MAP4K1BRAF
SCHEMBL1870184 0.88 BRAF (0.37) ACACBDDR2MAP4K3MAP4K1BRAF
SCHEMBL1571982 0.86 DDR2 (0.36) DDR2MAP4K3MAP4K1BRAFMAPK1
SCHEMBL1571686 0.84 MAP4K1 (0.40) DDR2MAP4K3MAP4K1BRAF
SCHEMBL13336170 0.84 MAP4K1 (0.42) MAP4K3MAP4K1BRAF
SCHEMBL1571377 0.84 BRAF (0.43) MAP4K3MAP4K1BRAF
SCHEMBL1571733 0.82 BRAF (0.39) ACACBDDR2MAP4K3MAP4K1BRAF
SCHEMBL1571735 0.82 BRAF (0.39) ACACBDDR2MAP4K3MAP4K1BRAF

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-2307385-A1 2 -ARYLAMINOQUINAZOLINES FOR TREATING PROLIFERATIVE DISEASES Novartis AG (CH) 2011-04-13 — — EP disclosed
WO-2009153313-A1 2 -ARYLAMINOQUINAZOLINES FOR TREATING PROLIFERATIVE DISEASES NOVARTIS AG (CH) 2009-12-23 — — WO disclosed
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