Sugi Predict

Sugi Predict / Compounds / SCHEMBL8930468

SCHEMBL8930468

SCHEMBL8930468

C=CCN1C[C@H](C)N([C@@H](c2cccc(O)c2)c2cccc(C(=O)N(C)c3ccc(OC)cc3)c2)C[C@H]1C

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ OPRD1 P41143 2/20 0.76
▸ OPRM1 P35372 1/20 0.64

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
SCHEMBL8083565 0.91 OPRD1 (0.85) OPRD1
SCHEMBL8930431 0.91 OPRD1 (0.85) OPRD1
SCHEMBL8930555 0.91 OPRD1 (0.66) OPRD1OPRM1
SCHEMBL8930524 0.91 OPRD1 (0.66) OPRD1OPRM1
SCHEMBL8076837 0.90 OPRD1 (0.78) OPRD1
SCHEMBL8069224 0.90 OPRD1 (0.86) OPRD1
SCHEMBL8930494 0.90 OPRD1 (0.79) OPRD1
SCHEMBL8930447 0.89 OPRD1 (0.64) OPRD1OPRM1
SCHEMBL8930470 0.88 OPRD1 (0.60) OPRD1OPRM1
SCHEMBL6936142 0.86 OPRD1 (0.80) OPRD1OPRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5552404-A COMPOUNDS FOR NEUROTRANSMITTERS FOR ANIMALS DELTA PHARMACEUTICALS, INC. (US) 1996-09-03 — — US claimed
US-5681830-A DIARYLMETHYL PIPERAZINE COMPOUNDS HAVING UTILITY IN MEDICAL THERAPY AS RECEPTOR-BINDING SPECIES DELTA PHARMACEUTICALS, INC. (US) 1997-10-28 — — US disclosed
US-5574159-A DIARYLMETHYL PIPERAZINES, RECEPTOR BINDING DELTA PHARMACEUTICALS, INC. (US) 1996-11-12 — — US disclosed
US-5552404-A COMPOUNDS FOR NEUROTRANSMITTERS FOR ANIMALS DELTA PHARMACEUTICALS, INC. (US) 1996-09-03 — — US disclosed
EP-0711289-A1 PIPERAZINE COMPOUNDS USED IN THERAPY DELTA PHARMACEUTICALS, INC. (US) 1996-05-15 — — EP disclosed
WO-1995004051-A1 PIPERAZINE COMPOUNDS USED IN THERAPY THE WELLCOME FOUNDATION LIMITED (GB) 1995-02-09 — — WO disclosed