SCHEMBL9544069

SCHEMBL9544069

CC(C)(C)OC(=O)N1c2ccccc2C[C@@H]1C(=O)N1[C@@H](c2ccccc2)CC[C@H]1C(=O)N1Cc2ccccc2C[C@@H]1CC(=O)O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
OPRD1 P41143 1/20 0.36
PRMT5 O14744 1/20 0.34
WDR77 Q9BQA1 1/20 0.34
NR1D1 P20393 1/20 0.33

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
SCHEMBL9544782 1.00 OPRD1 (0.36) OPRD1PRMT5WDR77NR1D1
SCHEMBL9542796 0.93 OPRD1 (0.35) OPRD1
SCHEMBL9542592 0.91 BCL2 (0.33) NR1D1
SCHEMBL9544357 0.90 ACE (0.38)
SCHEMBL9542806 0.90 ACE (0.38)
SCHEMBL9545027 0.90 ACE (0.38)
SCHEMBL9543801 0.90 BCL2 (0.32) NR1D1
SCHEMBL9544041 0.89 OPRD1 (0.40) OPRD1
SCHEMBL9544258 0.89 OPRD1 (0.40) OPRD1
SCHEMBL9545273 0.89 OPRD1 (0.40) OPRD1

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
WO-1993020099-A2 CCK AND/OR GASTRIN RECEPTOR LIGANDS FERRING B.V. (NL) 1993-10-14 WO claimed
WO-1993020099-A2 CCK AND/OR GASTRIN RECEPTOR LIGANDS FERRING B.V. (NL) 1993-10-14 WO disclosed