SCHEMBL31706651

SCHEMBL31706651

CCOC(=O)c1cnc(C2=CCOCC2)s1.CCOC(=O)c1cnc(C2=CCOCC2)s1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CDC7 O00311 3/20 0.53
▸ DBF4 Q9UBU7 3/20 0.53
▸ PIK3CA P42336 2/20 0.37
▸ PIK3CD O00329 2/20 0.37
▸ KDM4E B2RXH2 3/20 0.37
▸ ALDH1A1 P00352 3/20 0.37
▸ HPGD P15428 3/20 0.37
▸ TDP1 Q9NUW8 2/20 0.37
▸ L3MBTL1 Q9Y468 2/20 0.37
▸ LMNA P02545 2/20 0.36
▸ GLA P06280 2/20 0.36
▸ GAA P10253 2/20 0.36
▸ MAPT P10636 2/20 0.36
▸ HCRTR2 O43614 1/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ POLB P06746 1/20 0.36
▸ MAPK1 P28482 1/20 0.36
▸ HTT P42858 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ HSD17B10 Q99714 1/20 0.36

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
SCHEMBL30908171 1.00 CDC7 (0.53) CDC7DBF4PIK3CAPIK3CDKDM4E
SCHEMBL23146178 0.81 CDC7 (0.56) CDC7DBF4KDM4EALDH1A1HPGD
Lithium Ion SCHEMBL31705421 0.78 HTR2C (0.34) PIK3CAPIK3CDALDH1A1MAPTSMN1; SMN2
Lithium Ion SCHEMBL31705920 0.78 HTR2C (0.34) PIK3CAPIK3CDALDH1A1MAPTSMN1; SMN2
SCHEMBL19556453 0.75 NLRP3 (0.43) PIK3CAPIK3CDKDM4EALDH1A1L3MBTL1
Dioxane SCHEMBL21199902 0.72 CDC7 (0.51) CDC7DBF4PIK3CAKDM4EALDH1A1
SCHEMBL1539569 0.71 CDC7 (0.60) CDC7DBF4KDM4EALDH1A1HPGD
SCHEMBL23180250 0.70 CDC7 (0.43) CDC7DBF4ALDH1A1HPGDTDP1
SCHEMBL31706099 0.70 NLRP3 (0.39) PIK3CAPIK3CDKDM4EALDH1A1HPGD
SCHEMBL2225549 0.70 CDC7 (0.79) CDC7DBF4KDM4EALDH1A1HPGD

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-2025215110-A1 NEW AMIDE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND THEIR USES AS SOS1 INHIBITORS LES LABORATOIRES SERVIER (FR) 2025-10-16 — — WO disclosed
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