SCHEMBL9536801

SCHEMBL9536801

COC(=O)OC1CCCN1C(=O)Cc1c(Cl)cc(Cl)cc1Cl

nearest known ligand 0.41

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.39
OPRK1 P41145 8/20 0.39
OPRM1 P35372 3/20 0.39

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
SCHEMBL9538045 0.88 DRD1 (0.48)
SCHEMBL9535638 0.88 TACR1 (0.39) OPRK1
SCHEMBL9539327 0.85 OPRK1 (0.42) OPRK1OPRM1
SCHEMBL9537062 0.85 ALDH1A1 (0.50)
SCHEMBL9534996 0.84 OPRK1 (0.40) OPRK1OPRM1
SCHEMBL9535862 0.81 ALDH1A1 (0.39) OPRM1
SCHEMBL9727467 0.81 ALDH1A1 (0.55) POLBOPRK1
SCHEMBL9537713 0.81 KMT2A (0.55) POLB
SCHEMBL9535584 0.80 SMN1; SMN2 (0.38)
SCHEMBL9537518 0.77 ALDH1A1 (0.36) POLBOPRM1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0355599-B1 3-ARYL-PYRROLIDINE-2,4-DIONES BAYER AG (DE) 1993-05-19 EP disclosed
EP-0355599-A1 3-Aryl-pyrrolidine-2,4-diones BAYER AG (DE) 1990-02-28 EP disclosed