SCHEMBL24819979

SCHEMBL24819979

COC(=O)c1ccc2oc(-c3cccc(-c4ccc(Cl)cc4-c4nncn4C)c3)nc2c1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ HPSE Q9Y251 4/20 0.46
▸ DUSP1 P28562 1/20 0.44
▸ TP53 P04637 3/20 0.44
▸ LMNA P02545 1/20 0.44
▸ MAPT P10636 4/20 0.44
▸ RAB9A P51151 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ PTGS2 P35354 2/20 0.43
▸ HSPD1 P10809 1/20 0.43
▸ PTPN2 P17706 1/20 0.43
▸ PTPN1 P18031 1/20 0.43
▸ PTPN5 P54829 1/20 0.43
▸ HSPE1 P61604 1/20 0.43
▸ P2RY14 Q15391 4/20 0.42
▸ RXFP1 Q9HBX9 1/20 0.42
▸ AGPAT2 O15120 1/20 0.42

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
SCHEMBL30153028 1.00 HPSE (0.46) HPSEDUSP1TP53LMNAMAPT
SCHEMBL30152642 0.91 HPSE (0.56) HPSEDUSP1TP53LMNAMAPT
SCHEMBL24818715 0.90 MAPT (0.45) HPSETP53LMNAMAPTRAB9A
SCHEMBL30792049 0.85 AGPAT2 (0.38) HPSETP53MAPTRAB9ASMN1; SMN2
SCHEMBL24820737 0.85 AGPAT2 (0.38) HPSETP53MAPTRAB9ASMN1; SMN2
SCHEMBL24820343 0.83 RAB9A (0.46) HPSETP53MAPTRAB9ASMN1; SMN2
SCHEMBL30153171 0.83 CASP3 (0.42) HPSEDUSP1TP53LMNAMAPT
SCHEMBL24820705 0.83 CASP3 (0.42) HPSEDUSP1TP53LMNAMAPT
SCHEMBL24819976 0.83 P2RY14 (0.45) HPSETP53LMNAMAPTRAB9A
SCHEMBL30153187 0.83 P2RY14 (0.45) HPSETP53LMNAMAPTRAB9A

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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