SCHEMBL25020156

SCHEMBL25020156

CCC(C(C)C)C(C)C(C)CCN

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
GABRR1 P24046 2/20 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
SCHEMBL27442263 0.85 GABRR1 (0.32) GABRR1
SCHEMBL25472821 0.77 GABBR2 (0.36) GABRR1
SCHEMBL16297584 0.76
SCHEMBL3366284 0.76
SCHEMBL18965474 0.75 GABRR1 (0.32) GABRR1
SCHEMBL23194400 0.73 METAP1 (0.31) GABRR1
SCHEMBL18532308 0.71 ALDH1A1 (0.38)
SCHEMBL24482509 0.71
SCHEMBL16297525 0.71
SCHEMBL8692735 0.71

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
EP-3045206-B2 POLYCYCLIC CARBAMOYLPYRIDONE DERIVATIVE HAVING HIV INTEGRASE INHIBITORY ACTIVITY VIIV HEALTHCARE CO (US) 2023-02-15 EP disclosed