SCHEMBL1581823

SCHEMBL1581823

Cc1nnc(NC(=O)C2(c3ccc(S(C)(=O)=O)cc3)CC2C2CCCC2)s1

nearest known ligand 0.68

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ GCK P35557 2/20 0.68
▸ SMN1; SMN2 Q16637 2/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ POLB P06746 2/20 0.43
▸ ALDH1A1 P00352 5/20 0.40
▸ TSHR P16473 2/20 0.40
▸ USP2 O75604 2/20 0.40
▸ HSD17B10 Q99714 2/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ NPC1 O15118 2/20 0.39
▸ RAB9A P51151 1/20 0.39
▸ TP53 P04637 1/20 0.38
▸ HPGD P15428 1/20 0.38

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
SCHEMBL2666178 1.00 GCK (0.68) GCKSMN1; SMN2MEN1KMT2APOLB
SCHEMBL1582296 0.87 GCK (0.65) GCKSMN1; SMN2MEN1KMT2APOLB
SCHEMBL13757069 0.87 GCK (0.65) GCKSMN1; SMN2MEN1KMT2APOLB
SCHEMBL13757089 0.84 GCK (0.72) GCKSMN1; SMN2MEN1KMT2APOLB
SCHEMBL1581916 0.84 GCK (0.72) GCKSMN1; SMN2MEN1KMT2APOLB
SCHEMBL1581814 0.82 GCK (0.69) GCK
SCHEMBL12720709 0.82 GCK (0.69) GCK
SCHEMBL13757055 0.82 GCK (0.98) GCKSMN1; SMN2MEN1KMT2AALDH1A1
SCHEMBL1581876 0.82 GCK (0.98) GCKSMN1; SMN2MEN1KMT2AALDH1A1
SCHEMBL1581811 0.82 GCK (0.70) GCK

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
EP-1585739-B1 SUBSTITUTED ARYLCYCLOPROPYLACETAMIDES AS GLUCOKINASE ACTIVATORS LILLY CO ELI (US) 2011-04-20 — — EP disclosed
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