SCHEMBL27917319

SCHEMBL27917319

CNc1cccc(C2=CC3=CC4=NC(=CC5=NC(=CC6=NC(=CC2=N3)C=C6)C=C5)C=C4)c1

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ BRD4 O60885 1/20 0.33
▸ MAPT P10636 1/20 0.31
▸ PLK1 P53350 1/20 0.30

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
SCHEMBL27899567 0.83 KIF11 (0.30) —
SCHEMBL28557687 0.82 RAB9A (0.33) —
SCHEMBL28754048 0.81 IDO1 (0.33) —
SCHEMBL28751480 0.80 MAP4K4 (0.38) MAPT
SCHEMBL3107258 0.80 HSD17B1 (0.38) —
SCHEMBL28327044 0.80 IDO1 (0.33) —
SCHEMBL28663965 0.77 CLK4 (0.41) —
SCHEMBL28379974 0.77 MAOA (0.31) —
SCHEMBL11331090 0.77 MAOA (0.31) —
SCHEMBL28379953 0.77 MAOA (0.31) —

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
CN-103068395-A Therapeutic agent for disease YUASA MAKOTO 2013-04-24 — — CN disclosed
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