SCHEMBL24820662

SCHEMBL24820662

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

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 3/20 0.37
▸ CLK1 P49759 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ VSIR Q9H7M9 1/20 0.34
▸ IDO1 P14902 1/20 0.34
▸ LMNA P02545 1/20 0.33
▸ GAA P10253 1/20 0.33
▸ TP53 P04637 1/20 0.33
▸ GPR119 Q8TDV5 1/20 0.33
▸ VDR P11473 2/20 0.33
▸ ESR2 Q92731 2/20 0.33
▸ ESR1 P03372 1/20 0.33
▸ THRA P10827 1/20 0.33
▸ THRB P10828 1/20 0.33
▸ RXRA P19793 1/20 0.33
▸ PPARG P37231 1/20 0.33
▸ PPARD Q03181 1/20 0.33
▸ PPARA Q07869 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ ALDH1A1 P00352 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
SCHEMBL30152879 1.00 HPGD (0.37) HPGDCLK1SMN1; SMN2VSIRIDO1
SCHEMBL30153089 0.91 HPGD (0.39) HPGDCLK1SMN1; SMN2VSIRLMNA
SCHEMBL24821906 0.91 HPGD (0.39) HPGDCLK1SMN1; SMN2VSIRLMNA
SCHEMBL24820047 0.91 HPGD (0.45) HPGDCLK1SMN1; SMN2VSIRLMNA
SCHEMBL30152937 0.89 LMNA (0.39) HPGDCLK1SMN1; SMN2VSIRLMNA
SCHEMBL30153217 0.89 HPGD (0.38) HPGDCLK1SMN1; SMN2VSIRLMNA
SCHEMBL24820660 0.89 HPGD (0.38) HPGDCLK1SMN1; SMN2VSIRLMNA
SCHEMBL24818876 0.89 CLK1 (0.43) HPGDCLK1SMN1; SMN2VSIRLMNA
SCHEMBL24820726 0.89 LMNA (0.39) HPGDCLK1SMN1; SMN2VSIRLMNA
SCHEMBL24821895 0.88 HPGD (0.37) HPGDCLK1SMN1; SMN2VSIRLMNA

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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