SCHEMBL24818822

SCHEMBL24818822

Cn1cnnc1-c1cc(F)ccc1-c1cccc(-c2nc3cc(NCCN4CC(F)(F)C4)cc(C(F)(F)F)c3o2)c1

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ VSIR Q9H7M9 1/20 0.34
▸ CETP P11597 2/20 0.32
▸ CBLB Q13191 2/20 0.31
▸ HPGD P15428 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
SCHEMBL30152901 1.00 VSIR (0.34) VSIRCETPCBLBHPGD
SCHEMBL24820425 0.91 VSIR (0.34) VSIRCETPCBLBHPGD
SCHEMBL30152666 0.91 VSIR (0.34) VSIRCETPCBLBHPGD
SCHEMBL30152636 0.86 VSIR (0.34) VSIRCETPCBLBHPGD
SCHEMBL24818797 0.86 VSIR (0.34) VSIRCETPCBLBHPGD
SCHEMBL30152896 0.86 VSIR (0.34) VSIRCETPCBLBHPGD
SCHEMBL24820329 0.86 VSIR (0.34) VSIRCETPCBLBHPGD
SCHEMBL29189924 0.84 CHRNA7 (0.31) CETP
SCHEMBL24818674 0.82 VSIR (0.40) VSIRCETPCBLBHPGD
SCHEMBL24818951 0.81 ESR2 (0.34) VSIRCETPCBLBHPGD

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
WO-2022272248-A1 CBL-B MODULATORS AND USES THEREOF NIMBUS CLIO, INC. (US) 2022-12-29 — — WO disclosed
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