SCHEMBL24792178

SCHEMBL24792178

COCc1nc(Cl)c2cc(C3(OC)CCOCC3)c(OC)cc2n1

nearest known ligand 0.36

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ ALOX5 P09917 9/20 0.36
▸ PIK3CA P42336 3/20 0.33
▸ EGFR P00533 2/20 0.32
▸ ENPP1 P22413 3/20 0.32
▸ PDE10A Q9Y233 1/20 0.31

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
SCHEMBL30170830 0.86 ALOX5 (0.39) ALOX5
SCHEMBL24792638 0.84 SMN1; SMN2 (0.39) SMN1; SMN2ALOX5PIK3CAEGFRENPP1
SCHEMBL24792643 0.79 SMN1; SMN2 (0.35) SMN1; SMN2ALOX5PIK3CAEGFR
SCHEMBL30170858 0.74 ALOX5 (0.39) SMN1; SMN2ALOX5EGFR
SCHEMBL24792869 0.73 PDE4A (0.36) SMN1; SMN2EGFRENPP1
SCHEMBL30170859 0.73 PDE4A (0.36) SMN1; SMN2EGFRENPP1PDE10A
SCHEMBL30170868 0.70 ALOX5 (0.38) ALOX5
SCHEMBL24791345 0.69 MEN1 (0.33) SMN1; SMN2ALOX5PIK3CAPDE10A
SCHEMBL2725537 0.66 ENPP1 (0.47) SMN1; SMN2ENPP1PDE10A
SCHEMBL15819368 0.65 ENPP1 (0.51) SMN1; SMN2ENPP1PDE10A

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-2022262691-A1 HETEROCYCLIC COMPOUNDS AS SOS1 INHIBITORS BEIJING INNOCARE PHARMA TECH CO., LTD. (CN) 2022-12-22 — — WO disclosed
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