SCHEMBL30848841

SCHEMBL30848841

CC(C)c1cnc(S(C)(=O)=O)c2cnc(Cl)cc12

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GLP1R P43220 6/20 0.39
SMN1; SMN2 Q16637 1/20 0.33
FABP3 P05413 1/20 0.31
FABP4 P15090 1/20 0.31
FABP5 Q01469 1/20 0.31
NR1H2 P55055 1/20 0.30
NR1H3 Q13133 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
SCHEMBL24825118 1.00 GLP1R (0.39) GLP1RSMN1; SMN2FABP3FABP4FABP5
SCHEMBL30164985 0.91 SMN1; SMN2 (0.34) GLP1RSMN1; SMN2
SCHEMBL29206744 0.78 SMN1; SMN2 (0.31) SMN1; SMN2
SCHEMBL23578775 0.76 LMNA (0.33)
SCHEMBL24826762 0.75 LMNA (0.36)
SCHEMBL24826757 0.73 LMNA (0.32)
SCHEMBL30164827 0.73 LMNA (0.32)
SCHEMBL16849135 0.73 L3MBTL1 (0.40) GLP1RSMN1; SMN2FABP3FABP4FABP5
SCHEMBL24811598 0.73 KCNJ5 (0.37)
SCHEMBL30865601 0.73 KCNJ5 (0.37)

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
CN-117858872-A Heterocyclic EGFR inhibitors for the treatment of cancer 缆图药品公司 2024-04-09 CN disclosed