SCHEMBL15325678

SCHEMBL15325678

NCc1cc(F)cc(-c2cncc([N+](=O)[O-])c2N)c1

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 2/20 0.35
▸ ERN1 O75460 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.31
▸ HTT P42858 1/20 0.31
▸ RAB9A P51151 1/20 0.31
▸ LOXL2 Q9Y4K0 1/20 0.30
▸ NPSR1 Q6W5P4 1/20 0.30
▸ TYMS P04818 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
SCHEMBL15307252 0.82 CLK2 (0.42) —
SCHEMBL15365948 0.81 MAPT (0.39) MAPTALDH1A1HTTRAB9ANPSR1
SCHEMBL15365445 0.80 MAP4K4 (0.45) MAPT
SCHEMBL19678629 0.77 CSNK1D (0.43) MAPTRAB9A
SCHEMBL30143698 0.75 CLK2 (0.40) ALDH1A1NPSR1
SCHEMBL15322335 0.75 MAPT (0.30) MAPT
SCHEMBL15301947 0.75 CLK2 (0.40) ALDH1A1NPSR1
SCHEMBL15365950 0.71 MAPT (0.36) MAPTALDH1A1HTTRAB9A
SCHEMBL4457346 0.68 MAPT (0.50) MAPTALDH1A1HTTNPSR1
SCHEMBL13482304 0.67 MAPT (0.40) MAPTALDH1A1HTTRAB9A

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
WO-2013151708-A1 INDAZOLE INHIBITORS OF THE WNT SIGNAL PATHWAY AND THERAPEUTIC USES THEREOF SAMUMED, LLC (US) 2013-10-10 — — WO disclosed
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