SCHEMBL10143587

SCHEMBL10143587

COc1ccc(Nc2cc(Nc3cccc(OC(F)F)c3)nc(N3CCCC3)n2)cc1

nearest known ligand 0.82

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GALR2 O43603 15/20 0.82
GALR1 P47211 11/20 0.82
MAPK1 P28482 1/20 0.51
TAAR1 Q96RJ0 1/20 0.51
GBA1 P04062 1/20 0.51
MEN1 O00255 1/20 0.50
NPC1 O15118 1/20 0.50
RAB9A P51151 1/20 0.50
KMT2A Q03164 1/20 0.50
PIK3CA P42336 2/20 0.48

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
SCHEMBL10144390 0.91 GALR2 (0.81) GALR2GALR1MAPK1TAAR1GBA1
SCHEMBL10144388 0.90 GALR2 (1.00) GALR2GALR1MAPK1TAAR1GBA1
SCHEMBL10143409 0.88 GALR2 (0.82) GALR2GALR1MAPK1TAAR1GBA1
SCHEMBL10143582 0.86 GALR2 (0.98) GALR2GALR1
SCHEMBL10143429 0.85 GALR2 (1.00) GALR2GALR1
SCHEMBL10144353 0.85 GALR2 (1.00) GALR2GALR1TAAR1KMT2A
SCHEMBL10144392 0.84 GALR2 (1.00) GALR2GALR1MAPK1TAAR1GBA1
SCHEMBL10143796 0.83 GALR2 (1.00) GALR2GALR1MAPK1TAAR1MEN1
SCHEMBL10143418 0.79 GALR2 (0.86) GALR2GALR1MAPK1TAAR1GBA1
SCHEMBL10144344 0.79 GALR2 (1.00) GALR2GALR1MEN1NPC1RAB9A

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-2012009258-A2 PEPTIDOMIMETIC GALANIN RECEPTOR MODULATORS ROBERTS EDWARD (US) 2012-01-19 WO disclosed