SCHEMBL19569733

SCHEMBL19569733

BrCCOC1CCCCCCCC1

nearest known ligand 0.52

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.52
NAAA Q02083 1/20 0.32
CA1 P00915 2/20 0.31
CA2 P00918 2/20 0.31
HPGD P15428 1/20 0.30
CA12 O43570 1/20 0.30
CA9 Q16790 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
SCHEMBL20999374 1.00 NPC1 (0.52) NPC1NAAACA1CA2HPGD
SCHEMBL22669314 1.00 NPC1 (0.52) NPC1NAAACA1CA2HPGD
SCHEMBL15707913 1.00 NPC1 (0.52) NPC1NAAACA1CA2HPGD
SCHEMBL18097667 0.97
SCHEMBL21810782 0.92
SCHEMBL14795233 0.86
SCHEMBL4516905 0.83 NPC1 (0.47) NPC1NAAA
SCHEMBL10357183 0.83 NPC1 (0.61) NPC1NAAACA1CA2HPGD
SCHEMBL6377426 0.83 NPC1 (0.61) NPC1NAAACA1CA2HPGD
SCHEMBL6376493 0.83 NPC1 (0.61) NPC1NAAACA1CA2HPGD

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-2017193034-A1 MODULATORS OF THE INTEGRATED STRESS PATHWAY CALICO LIFE SCIENCES (US) 2017-11-09 WO disclosed