SCHEMBL9307300

SCHEMBL9307300

CCCCc1cc(N)ccc1C(=O)OCC

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.49
CYP1A2 P05177 3/20 0.49
CYP3A4 P08684 2/20 0.49
MAOA P21397 2/20 0.49
ALDH1A1 P00352 6/20 0.47
HSD17B10 Q99714 4/20 0.47
MAPT P10636 4/20 0.47
GAA P10253 3/20 0.47
RAB9A P51151 3/20 0.47
NPC1 O15118 2/20 0.47
ALOX15 P16050 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
CA12 O43570 2/20 0.45
CA1 P00915 2/20 0.45
CA2 P00918 2/20 0.45
CA7 P43166 2/20 0.45
CA9 Q16790 2/20 0.45
CA14 Q9ULX7 2/20 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
SCHEMBL8191128 0.91 LMNA (0.51) LMNACYP1A2CYP3A4MAOAALDH1A1
SCHEMBL8117430 0.90 CYP4F2 (0.48) LMNACYP1A2CYP3A4MAOAALDH1A1
SCHEMBL11784914 0.86 LMNA (0.56) LMNACYP1A2CYP3A4MAOAALDH1A1
SCHEMBL28537883 0.84 CA12 (0.62) LMNACYP1A2CYP3A4MAOAALDH1A1
SCHEMBL10082826 0.83 LMNA (0.53) LMNACYP1A2CYP3A4MAOAALDH1A1
SCHEMBL9357034 0.83 ALDH1A1 (0.48) LMNACYP1A2CYP3A4MAOAALDH1A1
SCHEMBL11032684 0.82 TSHR (0.48) LMNACYP1A2CYP3A4MAOAALDH1A1
SCHEMBL14465366 0.82 LMNA (0.51) LMNACYP1A2CYP3A4MAOAALDH1A1
SCHEMBL240794 0.81 GABRP (0.59) CYP3A4ALDH1A1HSD17B10MAPTGAA
SCHEMBL31117550 0.81 GABRP (0.59) CYP3A4ALDH1A1HSD17B10MAPTGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5352677-A Antihyperlipidemic agents KANEGAFUCHI KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1994-10-04 US disclosed
EP-0407200-B1 Cinnamamide derivatives KANEGAFUCHI CHEMICAL IND (JP) 1994-06-01 EP disclosed
US-5294643-A Cinnamamide derivative KANEGAFUCHI KAGAKU KOGYO KABUSHIKI (JP) 1994-03-15 US disclosed
US-5294624-A Antiartheriosclerosis KANEGAFUCHI KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1994-03-15 US disclosed
EP-0407200-A1 Cinnamamide derivatives KANEGAFUCHI KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1991-01-09 EP disclosed