SCHEMBL24820138

SCHEMBL24820138

COC(=O)c1cc(F)c2oc(-c3cc(-c4ccc(Cl)cc4-c4nncn4C)cc(C4CC4)n3)nc2c1

nearest known ligand 0.34

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MAP3K5 Q99683 2/20 0.34
▸ LMNA P02545 1/20 0.33
▸ GAA P10253 1/20 0.33
▸ GRM2 Q14416 2/20 0.32
▸ PSD A5PKW4 1/20 0.32
▸ KCNH2 Q12809 1/20 0.32
▸ RAF1 P04049 3/20 0.32
▸ THRB P10828 1/20 0.32
▸ CBLB Q13191 3/20 0.31
▸ SCN9A Q15858 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ GLP1R P43220 2/20 0.31
▸ SLC6A3 Q01959 1/20 0.30
▸ TP53 P04637 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
SCHEMBL30153076 1.00 MAP3K5 (0.34) MAP3K5LMNAGAAGRM2PSD
SCHEMBL30792001 1.00 MAP3K5 (0.34) MAP3K5LMNAGAAGRM2PSD
SCHEMBL30792046 0.93 MAP3K5 (0.34) MAP3K5LMNAGAAGRM2KCNH2
SCHEMBL24820582 0.93 MAP3K5 (0.34) MAP3K5LMNAGAAGRM2KCNH2
SCHEMBL30152957 0.93 MAP3K5 (0.34) MAP3K5LMNAGAAGRM2KCNH2
SCHEMBL24818967 0.90 CBLB (0.41) MAP3K5GRM2KCNH2CBLBALDH1A1
SCHEMBL30153054 0.90 CBLB (0.41) MAP3K5GRM2KCNH2CBLBALDH1A1
SCHEMBL30792053 0.90 CBLB (0.41) MAP3K5GRM2KCNH2CBLBALDH1A1
SCHEMBL24820737 0.88 AGPAT2 (0.38) ALDH1A1SMN1; SMN2TP53
SCHEMBL30792049 0.88 AGPAT2 (0.38) ALDH1A1SMN1; SMN2TP53

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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