SCHEMBL15714596

SCHEMBL15714596

O=C(N[C@H]1c2ccccc2C[C@H]1O)[C@H](Cc1ccccc1)C[C@H](O)CNS(=O)(=O)c1ccccc1

nearest known ligand 0.88

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
VIPR2 P41587 20/20 0.88

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
SCHEMBL17038181 0.94 VIPR2 (1.00) VIPR2
SCHEMBL17038291 0.94 VIPR2 (1.00) VIPR2
SCHEMBL17038261 0.94 VIPR2 (1.00) VIPR2
SCHEMBL17038294 0.94 VIPR2 (1.00) VIPR2
SCHEMBL17038264 0.94 VIPR2 (1.00) VIPR2
SCHEMBL17038296 0.94 VIPR2 (1.00) VIPR2
SCHEMBL17038195 0.94 VIPR2 (1.00) VIPR2
SCHEMBL17038186 0.94 VIPR2 (0.88) VIPR2
SCHEMBL17038188 0.94 VIPR2 (0.85) VIPR2
SCHEMBL17038191 0.93 VIPR2 (1.00) VIPR2

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-2014075093-A1 INHIBITORS OF CENTRAL NERVOUS SYSTEM VASOACTIVE INHIBITORY PEPTIDE RECEPTOR 2 THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2014-05-15 WO disclosed