SCHEMBL27260468

SCHEMBL27260468

CCOC(=O)NCC=C(C)C

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.41
▸ LMNA P02545 1/20 0.41
▸ HSD17B10 Q99714 1/20 0.41
▸ GAA P10253 2/20 0.39
▸ MGAM O43451 1/20 0.39
▸ SI P14410 1/20 0.39
▸ MGAM2 Q2M2H8 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ SMN1; SMN2 Q16637 3/20 0.37
▸ KMT2A Q03164 2/20 0.37
▸ TSHR P16473 1/20 0.37
▸ GLA P06280 1/20 0.37
▸ GLO1 Q04760 1/20 0.36
▸ TRPV1 Q8NER1 2/20 0.35
▸ ACHE P22303 1/20 0.35

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
SCHEMBL12393785 0.84 TRPA1 (0.55) ALDH1A1TRPV1
SCHEMBL12393840 0.84 TRPA1 (0.55) ALDH1A1TRPV1
SCHEMBL1147121 0.78 — —
SCHEMBL87647 0.77 — —
Methyl Alcohol SCHEMBL11130161 0.75 ALDH1A1 (0.46) ALDH1A1GAAMGAMSIMGAM2
SCHEMBL2338040 0.75 GAA (0.39) ALDH1A1LMNAHSD17B10GAAMGAM
SCHEMBL28815661 0.75 GAA (0.39) ALDH1A1LMNAHSD17B10GAAMGAM
SCHEMBL1694511 0.75 — —
SCHEMBL12003317 0.73 GLA (0.39) ALDH1A1LMNAHSD17B10GAAMGAM
SCHEMBL9195285 0.73 GAA (0.38) ALDH1A1LMNAHSD17B10GAAMGAM

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-1025675-C Composition containing carbamic acid derivatives for controlling insect pests SUMITOMO CHEMICAL COMPANG LIMI (JP) 1994-08-17 — — CN disclosed
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