SCHEMBL16557004

SCHEMBL16557004

Cc1ccc2ccc(N(c3ccc4ccc(COCO)nc4c3)c3ccc4ccc(COC(C)O)nc4c3)cc2n1

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 2/20 0.33
CYP1A2 P05177 2/20 0.33

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
SCHEMBL14930063 0.91 CYP1A2 (0.40) PDE10ACYP1A2
SCHEMBL12517318 0.80 PDE10A (0.35) PDE10ACYP1A2
SCHEMBL16557009 0.79 TERT (0.35) PDE10ACYP1A2
SCHEMBL16557013 0.76 GPBAR1 (0.37) PDE10A
SCHEMBL16557000 0.73 PDE10A (0.34) PDE10ACYP1A2
SCHEMBL2223464 0.72 CYP1A2 (0.59) CYP1A2
SCHEMBL12517340 0.66 CCR1 (0.48) PDE10ACYP1A2
SCHEMBL12517339 0.66 PDE10A (0.41) PDE10ACYP1A2
SCHEMBL12516490 0.63 TERT (0.50) PDE10ACYP1A2
SCHEMBL16601918 0.63 TERT (0.43) PDE10ACYP1A2

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
EP-2523937-B1 Multiphoton activable quinoline derivatives, their preparation and their uses CENTRE NAT RECH SCIENT (FR) 2015-03-11 EP disclosed