SCHEMBL27658591

SCHEMBL27658591

CCCC(O)c1ccc(C(=O)NCCCC(=O)O)cc1

nearest known ligand 0.57

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.57
CA1 P00915 1/20 0.52
CA2 P00918 1/20 0.52
FOLH1 Q04609 2/20 0.48
CYP1A2 P05177 1/20 0.48
CYP2C9 P11712 1/20 0.48
CYP2C19 P33261 1/20 0.48
NAAA Q02083 1/20 0.48
EPHX2 P34913 1/20 0.47
NPC1 O15118 1/20 0.47
RAB9A P51151 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
FABP4 P15090 1/20 0.47
PPARA Q07869 1/20 0.46
NR1H4 Q96RI1 1/20 0.46
GCGR P47871 3/20 0.46
HPGD P15428 1/20 0.46
GCG P01275 1/20 0.45

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
SCHEMBL27678802 0.92 MAPK1 (0.58) MAPK1CA1CA2FOLH1CYP1A2
SCHEMBL27658589 0.92 MAPK1 (0.58) MAPK1CA1CA2FOLH1CYP1A2
SCHEMBL11900276 0.92 GCG (0.52) MAPK1CA1CA2GCGRGCG
SCHEMBL27742353 0.84 MAPK1 (0.55) MAPK1CA1CA2FOLH1CYP1A2
SCHEMBL27678805 0.84 MAPK1 (0.57) MAPK1CA1CA2FOLH1CYP1A2
SCHEMBL1765927 0.81 PRSS1 (0.46) NPC1RAB9ASMN1; SMN2GCGRGCG
SCHEMBL9717451 0.81 MAPK1 (0.85) MAPK1CA1CA2FOLH1CYP1A2
SCHEMBL5658746 0.80 MAPK1 (0.72) MAPK1CA1CA2FOLH1CYP1A2
SCHEMBL11901113 0.79 MAPT (0.52) CYP1A2CYP2C19NPC1RAB9ASMN1; SMN2
SCHEMBL11962701 0.79 MAPT (0.52) CYP1A2CYP2C19NPC1RAB9ASMN1; SMN2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1968921-B Glucagon receptor antagonists, preparation and therapeutic uses LILLY CO ELI 2011-11-23 CN disclosed
CN-1968921-A Glucagon receptor antagonists, preparation and therapeutic uses LILLY CO ELI (US) 2007-05-23 CN disclosed