SCHEMBL29140990

SCHEMBL29140990

CCCCCCCCCCCCCCCC(=O)OC(CNCCO)OC(=O)CCCCCCCCCCCCCCC.COS(=O)(=O)O

nearest known ligand 0.46

Known targets — ChEMBL curated mechanism

ACHECHRM1CHRM3

The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 1/20 0.46
▸ MAPK1 P28482 1/20 0.46
▸ LMNA P02545 4/20 0.44
▸ CA12 O43570 1/20 0.42
▸ CA2 P00918 1/20 0.42
▸ CA7 P43166 1/20 0.42
▸ CA9 Q16790 1/20 0.42
▸ CA14 Q9ULX7 1/20 0.42
▸ CNR2 P34972 1/20 0.41
▸ PRKCA P17252 3/20 0.41
▸ PRKCE Q02156 1/20 0.41
▸ PRKCQ Q04759 1/20 0.41
▸ PRKCD Q05655 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.40
▸ TLR2 O60603 1/20 0.38
▸ NAAA Q02083 1/20 0.37
▸ LPAR6 P43657 1/20 0.37
▸ LPAR1 Q92633 1/20 0.37
▸ LPAR4 Q99677 1/20 0.37
▸ LPAR5 Q9H1C0 1/20 0.37

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
SCHEMBL30668439 0.91 MAPT (0.54) MAPTMAPK1LMNACNR2PRKCA
SCHEMBL28513664 0.84 LMNA (0.49) MAPTMAPK1LMNACA12CA2
SCHEMBL28363750 0.82 CA12 (0.40) MAPK1CA12CA2CA7CA9
SCHEMBL19409849 0.82 CA12 (0.40) MAPK1CA12CA2CA7CA9
SCHEMBL26637721 0.80 LMNA (0.41) LMNACA12CA2CA7CA9
Sulfuric Acid SCHEMBL20500593 0.78 MAPK1 (0.54) MAPTMAPK1LMNACNR2PRKCA
SCHEMBL27990209 0.77 ALDH1A1 (0.48) CA12CA2CA7CA9CA14
SCHEMBL29001437 0.77 CA2 (0.43) MAPTCA12CA2CA7CA9
SCHEMBL28580320 0.76 MAPT (0.44) MAPTMAPK1LMNACNR2PRKCA
SCHEMBL28504651 0.76 MAPT (0.44) MAPTMAPK1LMNAPRKCAPRKCE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119061713-A Recording method and composition set 精工爱普生株式会社 2024-12-03 — — CN disclosed
CN-118201538-A Surface cleaning device with odor control 尚科宁家运营有限公司 2024-06-14 — — CN disclosed
CN-220144215-U Surface cleaning device 尚科宁家运营有限公司 2023-12-08 — — CN disclosed
Send feedback