SCHEMBL28819488

SCHEMBL28819488

C[CH]CCC1CCC(=O)C1.[LiH]

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 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
SCHEMBL17815521 0.80 FAAH (0.34)
SCHEMBL17815519 0.80 FAAH (0.34)
SCHEMBL2690432 0.77
SCHEMBL6437615 0.77
SCHEMBL6438527 0.77
SCHEMBL23352117 0.76 CYP1A2 (0.38) CYP1A2
SCHEMBL6589588 0.74
SCHEMBL2693722 0.73 CYP1A2 (0.50) CYP1A2
SCHEMBL6526063 0.73 CYP1A2 (0.50) CYP1A2
SCHEMBL53075 0.72

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
CN-104788485-A Process for preparing antiviral agent BRISTOL MYERS SQUIBB CO 2015-07-22 CN claimed