SCHEMBL11311432

SCHEMBL11311432

Cc1ccc(C=CC(=O)OCC#CI)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA12 O43570 3/20 0.51
▸ CA7 P43166 3/20 0.51
▸ CA9 Q16790 3/20 0.51
▸ CA14 Q9ULX7 3/20 0.51
▸ CA1 P00915 2/20 0.51
▸ CA2 P00918 1/20 0.51
▸ CYP3A4 P08684 2/20 0.46
▸ MAPT P10636 2/20 0.45
▸ RAB9A P51151 2/20 0.44
▸ NPC1 O15118 1/20 0.44
▸ SMN1; SMN2 Q16637 1/20 0.44
▸ TTR P02766 1/20 0.44
▸ DPP4 P27487 1/20 0.44
▸ KMT2A Q03164 1/20 0.44
▸ ALDH1A1 P00352 3/20 0.43
▸ KDM4E B2RXH2 1/20 0.43
▸ GAA P10253 1/20 0.43
▸ FOS P01100 1/20 0.43
▸ JUN P05412 1/20 0.43
▸ HPGD P15428 2/20 0.42

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
SCHEMBL11311620 0.86 LMNA (0.58) MAPTRAB9ANPC1SMN1; SMN2KMT2A
SCHEMBL11311651 0.86 LMNA (0.58) MAPTRAB9ANPC1SMN1; SMN2KMT2A
SCHEMBL11312851 0.85 LMNA (0.50) CA12CA7CA9CA14CA1
SCHEMBL11312847 0.85 LMNA (0.50) CA12CA7CA9CA14CA1
SCHEMBL11309624 0.85 LMNA (0.58) CA12CA7CA9CA14MAPT
SCHEMBL11309627 0.85 LMNA (0.58) CA12CA7CA9CA14MAPT
SCHEMBL13957155 0.79 CA12 (0.77) CA12CA7CA9CA14CA1
SCHEMBL1894062 0.79 CA12 (0.77) CA12CA7CA9CA14CA1
SCHEMBL1894065 0.79 CA12 (0.77) CA12CA7CA9CA14CA1
SCHEMBL29153410 0.78 CA12 (0.60) CA12CA7CA9CA14CA1

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
US-4259350-A PROTECTING DEGRADABLE ORGANIC MATERIAL FROM FUNGAL OR INSECT ATTACK SANKYO COMPANY LIMITED (JP) 1981-03-31 — — US disclosed
Send feedback