SCHEMBL24818926

SCHEMBL24818926

COC(=O)c1cc(OC)c2oc(-c3cccc([Si@]4(c5nncn5C)C[C@@H](C)C4)c3)nc2c1

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 3/20 0.38
▸ CLK1 P49759 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ HSD17B10 Q99714 2/20 0.35
▸ GAA P10253 1/20 0.35
▸ THRB P10828 11/20 0.34
▸ ESR1 P03372 1/20 0.34
▸ ESR2 Q92731 1/20 0.34
▸ F2 P00734 2/20 0.33
▸ MAPT P10636 2/20 0.33
▸ TP53 P04637 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ MAPK1 P28482 1/20 0.33
▸ PDE4D Q08499 1/20 0.33

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
SCHEMBL24820656 0.89 CETP (0.33) HPGDSMN1; SMN2HSD17B10ESR2MAPT
SCHEMBL24821953 0.86 ESR1 (0.35) HPGDESR1ESR2
SCHEMBL24818909 0.86 ESR1 (0.33) HPGDESR1ESR2
SCHEMBL30152674 0.81 CBLB (0.50) —
SCHEMBL30792016 0.81 CBLB (0.50) —
SCHEMBL24818910 0.80 CD274 (0.35) THRBKDM4EALDH1A1
SCHEMBL24818936 0.74 CBL (0.32) —
SCHEMBL24818876 0.74 CLK1 (0.43) HPGDCLK1SMN1; SMN2HSD17B10GAA
SCHEMBL24818935 0.74 S1PR1 (0.34) ESR1ESR2
SCHEMBL24819910 0.70 CBLB (0.51) —

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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