SCHEMBL6451848

SCHEMBL6451848

CCCC1CC[C@@H]2C[C@H](c3ccc(C4NC(C)(C)CO4)c(F)c3)CC[C@@H]2C1

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
OPRL1 P41146 2/20 0.32
CYP2C9 P11712 1/20 0.30

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
SCHEMBL6451851 1.00 OPRL1 (0.32) OPRL1CYP2C9
SCHEMBL6460343 0.94 TP53 (0.32) OPRL1
SCHEMBL6460334 0.94 TP53 (0.32) OPRL1
SCHEMBL6452006 0.93 OPRL1 (0.31) OPRL1
SCHEMBL6452013 0.93 OPRL1 (0.31) OPRL1
SCHEMBL6460311 0.92 HTR1A (0.31) OPRL1
SCHEMBL6453441 0.92 HTR1A (0.31) OPRL1
SCHEMBL6460307 0.92 HTR1A (0.31) OPRL1
SCHEMBL6453435 0.92 HTR1A (0.31) OPRL1
SCHEMBL6457272 0.92 OPRL1 (0.31) OPRL1

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
US-6913797-B1 Decahydronaphthalene derivative DAINIPPON INK AND CHEMICALS, INC. (JP) 2005-07-05 US disclosed
EP-1108700-A1 DECAHYDRONAPHTHALENE DERIVATIVE DAINIPPON INK AND CHEMICALS, INC. (JP) 2001-06-20 EP disclosed