SCHEMBL6152031

SCHEMBL6152031

CCOC(=O)Oc1c[nH]nc1NC1CC(C)(c2ccc(I)cc2)OC1=O

nearest known ligand 0.34

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 1/20 0.32

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
SCHEMBL6585426 0.89 HPGDS (0.33)
SCHEMBL6152574 0.86 SYK (0.35) OPRM1
SCHEMBL6582104 0.84 IDO1 (0.34)
SCHEMBL6153355 0.81
SCHEMBL6581680 0.80 ALDH1A1 (0.36)
SCHEMBL6581698 0.77 ALDH1A1 (0.32) OPRM1
SCHEMBL6579675 0.76 TYMS (0.32) OPRM1
SCHEMBL6291829 0.75 JAK2 (0.40)
SCHEMBL6152278 0.72 ALDH1A1 (0.45)
SCHEMBL6288883 0.70 SLC26A6 (0.37)

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-1406610-B1 USE OF SUBSTITUTED GAMMA-LACTONE COMPOUNDS AS MEDICAMENTS GRUENENTHAL GMBH (DE) 2005-01-26 EP disclosed