SCHEMBL10143740

SCHEMBL10143740

COc1ccc(Nc2cc(N3CCCCC3)nc(NC3CCCCC3)n2)cc1

nearest known ligand 0.67

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GALR2 O43603 18/20 0.67
GALR1 P47211 8/20 0.67
CTSL P07711 1/20 0.57
CTSS P25774 1/20 0.57
CTSK P43235 1/20 0.57

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
SCHEMBL10143746 0.85 GALR2 (0.72) GALR2GALR1
SCHEMBL10143556 0.83 GALR2 (0.80) GALR2GALR1
SCHEMBL10143407 0.82 GALR2 (0.72) GALR2GALR1CTSLCTSSCTSK
SCHEMBL10144339 0.80 GALR2 (0.82) GALR2GALR1
SCHEMBL10143427 0.80 GALR2 (1.00) GALR2GALR1
SCHEMBL10143590 0.80 GALR2 (0.85) GALR2GALR1
SCHEMBL10143598 0.80 GALR2 (1.00) GALR2GALR1
SCHEMBL10143575 0.80 GALR2 (1.00) GALR2GALR1
SCHEMBL10144389 0.79 GALR2 (1.00) GALR2GALR1CTSLCTSSCTSK
SCHEMBL10144343 0.79 GALR2 (1.00) GALR2GALR1CTSLCTSSCTSK

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