SCHEMBL27899567

SCHEMBL27899567

CNc1ccc(C2=CC3=CC4=NC(=CC5=NC(=CC6=NC(=CC2=N3)C=C6)C=C5)C=C4)cc1

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ KIF11 P52732 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
SCHEMBL27917319 0.83 BRD4 (0.33) —
SCHEMBL473159 0.80 MAOA (0.32) —
SCHEMBL27686682 0.79 KIF11 (0.35) KIF11
SCHEMBL27793989 0.79 MAPT (0.35) —
SCHEMBL28087954 0.79 ALDH1A1 (0.30) —
Hydrochloric Acid SCHEMBL27597701 0.79 ESR1 (0.30) —
SCHEMBL28289587 0.79 ALDH1A1 (0.30) —
SCHEMBL28295369 0.79 ESR1 (0.30) —
Hydrochloric Acid SCHEMBL27597698 0.79 ESR1 (0.30) —
SCHEMBL28187477 0.78 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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