SCHEMBL24818876

SCHEMBL24818876

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

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CLK1 P49759 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ HPGD P15428 4/20 0.40
▸ HSD17B10 Q99714 2/20 0.40
▸ MAPT P10636 2/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ MAPK1 P28482 1/20 0.40
▸ HPSE Q9Y251 4/20 0.37
▸ GAA P10253 2/20 0.37
▸ MAP3K5 Q99683 1/20 0.36
▸ CTSA P10619 2/20 0.35
▸ VSIR Q9H7M9 1/20 0.35
▸ HDAC6 Q9UBN7 1/20 0.35
▸ ESR1 P03372 1/20 0.35
▸ ESR2 Q92731 1/20 0.35
▸ TP53 P04637 2/20 0.34
▸ THRB P10828 1/20 0.34
▸ LCLAT1 Q6UWP7 1/20 0.34
▸ LMNA P02545 1/20 0.34

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
SCHEMBL24820047 0.92 HPGD (0.45) CLK1SMN1; SMN2HPGDMAPTGAA
SCHEMBL30153089 0.92 HPGD (0.39) CLK1SMN1; SMN2HPGDHSD17B10MAPT
SCHEMBL24821906 0.92 HPGD (0.39) CLK1SMN1; SMN2HPGDHSD17B10MAPT
SCHEMBL24820726 0.91 LMNA (0.39) CLK1SMN1; SMN2HPGDHSD17B10MAPT
SCHEMBL30153217 0.91 HPGD (0.38) CLK1SMN1; SMN2HPGDHSD17B10MAPT
SCHEMBL24820660 0.91 HPGD (0.38) CLK1SMN1; SMN2HPGDHSD17B10MAPT
SCHEMBL30152937 0.91 LMNA (0.39) CLK1SMN1; SMN2HPGDHSD17B10MAPT
SCHEMBL24820662 0.89 HPGD (0.37) CLK1SMN1; SMN2HPGDHSD17B10MAPT
SCHEMBL24821895 0.89 HPGD (0.37) CLK1SMN1; SMN2HPGDHSD17B10MAPT
SCHEMBL24820064 0.89 HPGD (0.37) CLK1SMN1; SMN2HPGDHSD17B10MAPT

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4359381-A1 CBL-B MODULATORS AND USES THEREOF Nimbus Clio, Inc. (US) 2024-05-01 — — EP disclosed
WO-2022272248-A1 CBL-B MODULATORS AND USES THEREOF NIMBUS CLIO, INC. (US) 2022-12-29 — — WO disclosed
WO-2022272248-A1 CBL-B MODULATORS AND USES THEREOF NIMBUS CLIO, INC. (US) 2022-12-29 — — WO disclosed
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