SCHEMBL316934

SCHEMBL316934

CCC(CCO)CCCC(C)CCCC(C)C

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.54
BLM P54132 1/20 0.45
PTPN1 P18031 3/20 0.44
ALDH1A1 P00352 4/20 0.41
ALOX15 P16050 2/20 0.40
CYP3A4 P08684 2/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
CA2 P00918 2/20 0.34
TDP1 Q9NUW8 1/20 0.32
TSHR P16473 1/20 0.31
PTPN2 P17706 1/20 0.31
CDC25B P30305 1/20 0.31

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
SCHEMBL10045743 1.00 LMNA (0.54) LMNABLMPTPN1ALDH1A1ALOX15
Alcohol SCHEMBL3678305 0.98 LMNA (0.52) LMNABLMPTPN1ALDH1A1ALOX15
SCHEMBL24555879 0.94 LMNA (0.52) LMNABLMPTPN1ALDH1A1ALOX15
SCHEMBL17526505 0.93 ALDH1A1 (0.46) LMNABLMPTPN1ALDH1A1ALOX15
SCHEMBL317730 0.93 ALDH1A1 (0.46) LMNABLMPTPN1ALDH1A1ALOX15
SCHEMBL17526511 0.93 ALDH1A1 (0.46) LMNABLMPTPN1ALDH1A1ALOX15
Sulfuric Acid SCHEMBL14776390 0.91 LMNA (0.45) LMNABLMPTPN1ALDH1A1ALOX15
Sulfuric Acid SCHEMBL316776 0.89 LMNA (0.43) LMNABLMPTPN1ALDH1A1ALOX15
SCHEMBL17526728 0.89 ALDH1A1 (0.46) LMNABLMPTPN1ALDH1A1CYP3A4
SCHEMBL17526518 0.89 ALDH1A1 (0.46) LMNABLMPTPN1ALDH1A1CYP3A4

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 72 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8603449-B2 Rinse-off conditioning composition comprising a near-terminal branched alcohol THE PROCTER & GAMBLE COMPANY (US) 2013-12-10 US claimed
EP-2593073-A2 RINSE-OFF CONDITIONING COMPOSITION COMPRISING A NEAR-TERMINAL BRANCHED ALCOHOL The Procter and Gamble Company (US) 2013-05-22 EP claimed
US-20120014901-A1 Rinse-Off Conditioning Composition Comprising a Near-Terminal Branched Alcohol THE PROCTER & GAMBLE COMPANY 2012-01-19 US claimed
WO-2012009522-A2 RINSE-OFF CONDITIONING COMPOSITION COMPRISING A NEAR-TERMINAL BRANCHED ALCOHOL THE PROCTER & GAMBLE COMPANY (US) 2012-01-19 WO claimed
CN-108026062-B Process for the hydroformylation of 2-substituted butadienes and process for the production of secondary products thereof, in particular ambrox 巴斯夫欧洲公司 2022-04-12 CN disclosed
EP-3319951-B1 METHOD FOR THE HYDROFORMYLATION OF 2-SUBSTITUTED BUTADIENES AND FOR THE PREPARATION OF PRODUCTS DERIVED FROM SAME, PARTICULARLY FROM AMBROX BASF SE (DE) 2021-09-08 EP disclosed
US-10315975-B2 Method for the hydroformylation of 2-substituted butadienes and the production of secondary products thereof, especially ambrox BASF SE (DE) 2019-06-11 US disclosed
US-20180273458-A1 METHOD FOR THE HYDROFORMYLATION OF 2-SUBSTITUTED BUTADIENES AND THE PRODUCTION OF SECONDARY PRODUCTS THEREOF, ESPECIALLY AMBROX RUPRECHT-KARLS-UNIVERSITAT HEIDELBERG (DE) 2018-09-27 US disclosed
EP-2969020-B1 SPECIFIC UNSATURATED AND BRANCHED FUNCTIONAL MATERIALS FOR USE IN CONSUMER PRODUCTS PROCTER & GAMBLE (US) 2017-11-29 EP disclosed
EP-2328856-B1 SPECIFIC POLYBRANCHED ALDEHYDES, ALCOHOLS SURFACTANTS AND CONSUMER PRODUCTS BASED THEREON PROCTER & GAMBLE (US) 2017-03-08 EP disclosed
EP-2328856-B1 SPECIFIC POLYBRANCHED ALDEHYDES, ALCOHOLS SURFACTANTS AND CONSUMER PRODUCTS BASED THEREON PROCTER & GAMBLE (US) 2017-03-08 EP disclosed
WO-2014150171-A1 SPECIFIC UNSATURATED AND BRANCHED FUNCTIONAL MATERIALS FOR USE IN CONSUMER PRODUCTS THE PROCTER & GAMBLE COMPANY (US) 2014-09-25 WO disclosed
US-20100137649-A1 Specific Branched Aldehydes, Alcohols, Surfactants, and Consumer Products Based Thereon THE PROCTER & GAMBLE COMPANY 2010-06-03 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
US-20100105958-A1 Specific Polybranched Polyaldehydes, Polyalcohols, and Surfactants, and Consumer Products Based Thereon THE PROCTER & GAMBLE COMPANY 2010-04-29 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
WO-2010033979-A2 SPECIFIC POLYBRANCHED POLYALDEHYDES, POLYALCOHOLS, AND SURFACTANTS AND CONSUMER PRODUCTS BASED THEREON THE PROCTER & GAMBLE COMPANY (US) 2010-03-25 WO disclosed
WO-2010033979-A2 SPECIFIC POLYBRANCHED POLYALDEHYDES, POLYALCOHOLS, AND SURFACTANTS AND CONSUMER PRODUCTS BASED THEREON THE PROCTER & GAMBLE COMPANY (US) 2010-03-25 WO disclosed
WO-2010033976-A2 SPECIFIC BRANCHED ALDEHYDES, ALCOHOLS, SURFACTANTS AND CONSUMER PRODUCTS BASED THEREON THE PROCTER & GAMBLE COMPANY (US) 2010-03-25 WO disclosed
WO-2010033976-A2 SPECIFIC BRANCHED ALDEHYDES, ALCOHOLS, SURFACTANTS AND CONSUMER PRODUCTS BASED THEREON THE PROCTER & GAMBLE COMPANY (US) 2010-03-25 WO 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 (5 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-10315975-B2 Method for the hydroformylation of 2-substituted butadienes and the production of secondary products thereof, especially ambrox ALOX12, ALOX15, ALOX5 LMNA 2087/4885BLM 657/4885PTPN1 4835/4885
US-20180273458-A1 METHOD FOR THE HYDROFORMYLATION OF 2-SUBSTITUTED BUTADIENES AND THE PRODUCTION OF SECONDARY PRODUCTS THEREOF, ESPECIALLY AMBROX ALOX12, ALOX15, ALOX5 LMNA 2087/4885BLM 657/4885PTPN1 4835/4885
US-20100137649-A1 Specific Branched Aldehydes, Alcohols, Surfactants, and Consumer Products Based Thereon ADH5, ADH1A, ADH1C LMNA 2589/4885BLM 1792/4885PTPN1 4053/4885
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-20120014901-A1 Rinse-Off Conditioning Composition Comprising a Near-Terminal Branched Alcohol ITGB7, ARG1, ITGB1 LMNA 296/4885BLM 805/4885PTPN1 3503/4885

“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.