SCHEMBL7954523

SCHEMBL7954523

COc1ccc(S(=O)(=O)N(CC(C)C)CC(O)[C@H](Cc2ccccc2)NC(=O)[C@H](C)CS(C)(=O)=O)cc1

nearest known ligand 0.66

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
SPPL2A Q8TCT8 1/20 0.54

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
SCHEMBL30585310 1.00 SPPL2A (0.54) SPPL2A
SCHEMBL6102665 1.00 SPPL2A (0.54) SPPL2A
SCHEMBL6099197 0.93 MLNR (0.47)
SCHEMBL4913960 0.92 SPPL2A (0.53) SPPL2A
SCHEMBL14113250 0.92 SPPL2A (0.53) SPPL2A
SCHEMBL9082056 0.92 SPPL2A (0.55) SPPL2A
SCHEMBL6099268 0.91 MLNR (0.45)
SCHEMBL4911599 0.91 SPPL2A (0.53) SPPL2A
SCHEMBL14113255 0.91 SPPL2A (0.53) SPPL2A
SCHEMBL5935417 0.91 SPPL2A (0.53) SPPL2A

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
US-6169085-B1 A VIRICIDE FOR PREVENTING AND TREATING RETROVIRAL INFECTION OR THE SPREAD OF A RETROVIRUS, INHIBITING REPLICATION OF A RETROVIRUS AND TREATING AIDS G. D. SEARLE & COMPANY 2001-01-02 US disclosed