SCHEMBL24818673

SCHEMBL24818673

COC(=O)c1cc(C(F)(F)F)c2oc(-c3cccc(-c4ccc(F)cc4-c4nncn4C)c3)nc2c1

nearest known ligand 0.37

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 3/20 0.37
▸ CETP P11597 3/20 0.37
▸ CLK1 P49759 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ VSIR Q9H7M9 1/20 0.34
▸ S1PR1 P21453 2/20 0.34
▸ CBLB Q13191 2/20 0.33
▸ TP53 P04637 2/20 0.33
▸ LMNA P02545 1/20 0.33
▸ GAA P10253 1/20 0.33
▸ GPR119 Q8TDV5 1/20 0.33
▸ SCN9A Q15858 1/20 0.33
▸ MAPT P10636 2/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ MAPK1 P28482 1/20 0.33
▸ HSD17B10 Q99714 1/20 0.33
▸ HPSE Q9Y251 1/20 0.32

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
SCHEMBL30153040 1.00 HPGD (0.37) HPGDCETPCLK1SMN1; SMN2VSIR
SCHEMBL30792096 1.00 HPGD (0.37) HPGDCETPCLK1SMN1; SMN2VSIR
SCHEMBL30153029 0.95 HPGD (0.37) HPGDCETPCLK1SMN1; SMN2VSIR
SCHEMBL24820064 0.95 HPGD (0.37) HPGDCETPCLK1SMN1; SMN2VSIR
SCHEMBL30153258 0.94 HPGD (0.37) HPGDCETPCLK1SMN1; SMN2VSIR
SCHEMBL24821895 0.94 HPGD (0.37) HPGDCETPCLK1SMN1; SMN2VSIR
SCHEMBL24819809 0.92 CETP (0.38) HPGDCETPCLK1SMN1; SMN2S1PR1
SCHEMBL30153136 0.92 CETP (0.38) HPGDCETPCLK1SMN1; SMN2S1PR1
SCHEMBL24818914 0.91 HPGD (0.37) HPGDCETPCLK1SMN1; SMN2VSIR
SCHEMBL24818726 0.91 HPGD (0.37) HPGDCETPVSIRS1PR1CBLB

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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