SCHEMBL10045748

SCHEMBL10045748

CC(C)CCCC(C)CCCC(C)CCCS(=O)(=O)O

nearest known ligand 0.54

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.54
BLM P54132 2/20 0.50
PTPN1 P18031 3/20 0.40
MEN1 O00255 1/20 0.40
CYP3A4 P08684 1/20 0.40
ALOX15 P16050 1/20 0.40
KMT2A Q03164 1/20 0.40
APP P05067 1/20 0.39
PTPN2 P17706 1/20 0.37
CDC25B P30305 1/20 0.37
PTGS1 P23219 2/20 0.33
PDE4A P27815 2/20 0.33
SNCA P37840 1/20 0.33
PDE3A Q14432 1/20 0.33
TP53 P04637 1/20 0.32
SLC6A6 P31641 1/20 0.32
CYP2C19 P33261 1/20 0.32

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
SCHEMBL2240223 1.00 LMNA (0.54) LMNABLMPTPN1MEN1CYP3A4
SCHEMBL14518378 0.94 LMNA (0.52) LMNABLMPTPN1MEN1CYP3A4
SCHEMBL8812353 0.91 LMNA (0.54) LMNABLMPTPN1MEN1CYP3A4
SCHEMBL329052 0.91 APP (0.46) LMNABLMMEN1KMT2AAPP
SCHEMBL966471 0.89 APP (0.44) LMNABLMAPPPTGS1PDE4A
SCHEMBL28621315 0.89 APP (0.44) LMNABLMAPPPTGS1PDE4A
Ammonia Solution, Strong SCHEMBL18008289 0.89 APP (0.44) LMNABLMAPPPTGS1PDE4A
SCHEMBL14915359 0.86 APP (0.42) LMNABLMAPPPTGS1PDE4A
SCHEMBL16308960 0.86 APP (0.42) LMNABLMAPPPTGS1PDE4A
SCHEMBL28530390 0.86 APP (0.42) LMNABLMAPPPTGS1PDE4A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2650275-A1 Specific polybranched alcohols and consumer products based thereon The Procter & Gamble Company (US) 2013-10-16 EP disclosed
EP-2650280-A1 Specific polybranched surfactants and consumer products based thereon The Procter & Gamble Company (US) 2013-10-16 EP disclosed
US-8299308-B2 Specific branched aldehydes, alcohols, surfactants, and consumer products based thereon THE PROCTER & GAMBLE COMPANY (US) 2012-10-30 US disclosed
US-8232432-B2 Specific branched aldehydes, alcohols, surfactants, and consumer products based thereon THE PROCTER & GAMBLE COMPANY (US) 2012-07-31 US disclosed
US-20120010432-A1 Specific Branched Aldehydes, Alcohols, Surfactants, and Consumer Products Based Thereon SCHEIBEL JEFFREY JOHN (US) 2012-01-12 US disclosed
US-20120010423-A1 Specific Branched Aldehydes, Alcohols, Surfactants, and Consumer Products Based Thereon SCHEIBEL JEFFREY JOHN (US) 2012-01-12 US disclosed
US-7994369-B2 Specific polybranched polyaldehydes, polyalcohols, and surfactants, and consumer products based thereon THE PROCTER & GAMBLE COMPANY (US) 2011-08-09 US disclosed
US-20100105958-A1 Specific Polybranched Polyaldehydes, Polyalcohols, and Surfactants, and Consumer Products Based Thereon THE PROCTER & GAMBLE COMPANY 2010-04-29 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100105958-A1 Specific Polybranched Polyaldehydes, Polyalcohols, and Surfactants, and Consumer Products Based Thereon ADH1C, ADH1A, ADH5 LMNA 1144/4885BLM 1818/4885PTPN1 4776/4885
US-20120010432-A1 Specific Branched Aldehydes, Alcohols, Surfactants, and Consumer Products Based Thereon ADH5, ADH1A, ADH1C LMNA 2589/4885BLM 1792/4885PTPN1 4053/4885
US-20120010423-A1 Specific Branched Aldehydes, Alcohols, Surfactants, and Consumer Products Based Thereon ADH5, ADH1A, ADH1C LMNA 2589/4885BLM 1792/4885PTPN1 4053/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.