SCHEMBL31124102

SCHEMBL31124102

C[C@H]1CCCN1CCC=O

nearest known ligand 0.45

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 20/20 0.45

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
SCHEMBL2555895 1.00 HRH3 (0.45) HRH3
SCHEMBL2553573 0.94 CXCR4 (0.46) HRH3
SCHEMBL27806458 0.83 HRH3 (0.47) HRH3
SCHEMBL2559845 0.81 HRH3 (0.30) HRH3
SCHEMBL29796695 0.79
SCHEMBL2559635 0.77 SIGMAR1 (0.31)
SCHEMBL2556327 0.77 S1PR1 (0.38) HRH3
SCHEMBL2881366 0.77
SCHEMBL2876822 0.77
SCHEMBL2882264 0.77

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-2024204554-A1 SPIROCYCLIC MORPHINAN DERIVATIVE 日本ケミファ株式会社 2024-10-03 WO claimed
WO-2024204554-A1 SPIROCYCLIC MORPHINAN DERIVATIVE 日本ケミファ株式会社 2024-10-03 WO disclosed