SCHEMBL15775768

SCHEMBL15775768

O=C1N=C(c2ccc(Cl)cc2)Cc2c1cccc2[N+](=O)[O-]

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.40
MAPT P10636 6/20 0.40
RECQL P46063 1/20 0.40
MCL1 Q07820 1/20 0.40
RXFP1 Q9HBX9 1/20 0.40
S100A4 P26447 2/20 0.38
MEN1 O00255 5/20 0.37
MAPK1 P28482 2/20 0.37
ALDH1A1 P00352 2/20 0.36
TDP1 Q9NUW8 2/20 0.36
NOTUM Q6P988 1/20 0.35
PTPRC P08575 1/20 0.35
EIF4E P06730 1/20 0.35
HTT P42858 3/20 0.35
NPSR1 Q6W5P4 3/20 0.35
L3MBTL1 Q9Y468 3/20 0.35
LMNA P02545 2/20 0.35
RAB9A P51151 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
NPC1 O15118 2/20 0.35

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
SCHEMBL15775583 0.88 TDP1 (0.49) KMT2AMAPTRECQLMCL1RXFP1
SCHEMBL15775915 0.87 MAPT (0.40) KMT2AMAPTRECQLMCL1RXFP1
SCHEMBL15775327 0.84 KMT2A (0.38) KMT2AMAPTRECQLMCL1RXFP1
SCHEMBL15775318 0.84 HTR7 (0.42) KMT2AMAPTRECQLMCL1RXFP1
SCHEMBL15776267 0.79 NOTUM (0.39) KMT2AMAPTMEN1ALDH1A1NOTUM
SCHEMBL15775479 0.79 NOTUM (0.39) RXFP1NOTUMHTTNPSR1L3MBTL1
Hydrochloric Acid SCHEMBL15775431 0.77 NOTUM (0.38) KMT2AMAPTRXFP1MEN1NOTUM
SCHEMBL15776282 0.75 CYP19A1 (0.41) RXFP1ALDH1A1NOTUM
SCHEMBL15775233 0.72 MAPT (0.43) KMT2AMAPTRECQLMCL1RXFP1
SCHEMBL1721464 0.69 ALDH1A1 (0.71) KMT2AMAPTS100A4MEN1MAPK1

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-2014087165-A1 TANKYRASE INHIBITORS UNIVERSITY OF BATH (GB) 2014-06-12 WO disclosed