SCHEMBL24819864

SCHEMBL24819864

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

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ CETP P11597 1/20 0.37
▸ VSIR Q9H7M9 1/20 0.34
▸ CBLB Q13191 7/20 0.34
▸ HPGD P15428 1/20 0.33
▸ NR1H2 P55055 1/20 0.31
▸ NR1H3 Q13133 1/20 0.31
▸ SCN9A Q15858 1/20 0.31
▸ ESR1 P03372 1/20 0.31
▸ ESR2 Q92731 1/20 0.31
▸ S1PR1 P21453 1/20 0.31
▸ P2RX7 Q99572 1/20 0.30
▸ HSD11B1 P28845 1/20 0.30
▸ LMNA P02545 1/20 0.30
▸ GAA P10253 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
SCHEMBL30152764 1.00 CETP (0.37) CETPVSIRCBLBHPGDNR1H2
SCHEMBL24819872 0.92 CETP (0.39) CETPVSIRCBLBNR1H2NR1H3
SCHEMBL30153156 0.92 CETP (0.39) CETPVSIRCBLBNR1H2NR1H3
SCHEMBL30153245 0.87 ESR2 (0.34) CETPVSIRCBLBHPGDSCN9A
SCHEMBL24818951 0.87 ESR2 (0.34) CETPVSIRCBLBHPGDSCN9A
SCHEMBL24819899 0.87 CBLB (0.39) VSIRCBLBHPGDSCN9AS1PR1
SCHEMBL24818674 0.87 VSIR (0.40) CETPVSIRCBLBHPGDS1PR1
SCHEMBL24818914 0.86 HPGD (0.37) CETPVSIRCBLBHPGDSCN9A
SCHEMBL24818726 0.86 HPGD (0.37) CETPVSIRCBLBHPGDSCN9A
SCHEMBL30152816 0.86 HPGD (0.37) CETPVSIRCBLBHPGDSCN9A

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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