SCHEMBL20122924

SCHEMBL20122924

CCc1cc2c([nH]c3c(C4=CC(C)C(OCCn5cccn5)C=C4)cc(Br)cc32)c(C)n1

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
GPR39 O43194 1/20 0.31

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
SCHEMBL22474563 0.76 PRKAB2 (0.42)
SCHEMBL30664132 0.76 PRKAB2 (0.42)
SCHEMBL20122734 0.67 PRKAB2 (0.43)
SCHEMBL30664159 0.65 PRKAB2 (0.44)
SCHEMBL30664205 0.62 DYRK1A (0.49)
SCHEMBL20123030 0.62 DYRK1A (0.49)
SCHEMBL20351072 0.58 IDO1 (0.38) GPR39
SCHEMBL20122732 0.54 PRKAB2 (0.48)
SCHEMBL29817742 0.53 MAPT (0.53)
SCHEMBL25783627 0.52 IDO1 (0.43)

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-3318563-A1 SUBSTITUTED PYRIDO[3,4-B]INDOLES FOR THE TREATMENT OF CARTILAGE DISORDERS SANOFI (FR) 2018-05-09 EP disclosed