SCHEMBL2187374

SCHEMBL2187374

NC(=O)CCC(=O)N(CCO)CCO

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.34
HPGD P15428 1/20 0.34
POLB P06746 1/20 0.34
CA12 O43570 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA9 Q16790 1/20 0.32
LMNA P02545 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
SCHEMBL1905343 0.88 LMNA (0.39) ALDH1A1HPGDPOLBCA12CA1
SCHEMBL1232870 0.87 ALDH1A1 (0.41) ALDH1A1HPGDPOLBCA12CA1
SCHEMBL2149157 0.86 LMNA (0.38) ALDH1A1HPGDPOLBLMNA
SCHEMBL9823668 0.86 LMNA (0.43) ALDH1A1HPGDPOLBCA12CA1
SCHEMBL7568696 0.86 NTRK2 (0.35) ALDH1A1HPGDLMNA
Terephthalic Acid SCHEMBL5953884 0.84 TSHR (0.40) ALDH1A1POLBCA12CA1CA2
SCHEMBL8420703 0.80 LMNA (0.38) ALDH1A1LMNA
SCHEMBL1387466 0.79 ALDH1A1 (0.39) ALDH1A1HPGDPOLBCA12CA1
SCHEMBL3351986 0.79 ALDH1A1 (0.57) ALDH1A1HPGDPOLBCA12CA1
Octadecanoic Acid Amide SCHEMBL8810420 0.78 SOAT1 (0.50) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105542108-A Easily-dyeable polyurethane resin used for superfine fiber synthetic leather and preparation method thereof HUAFON MICROFIBRE (SHANGHAI) CO LTD 2016-05-04 CN claimed
CN-111378172-A Force-induced responsive polymer with multi-hybrid network structure 翁秋梅 2020-07-07 CN disclosed
CN-111378177-A Energy absorption method based on force-induced responsive polymer with hetero-network structure 翁秋梅 2020-07-07 CN disclosed
CN-111378181-A Force-induced responsive polymer with single-hybrid network structure 翁秋梅 2020-07-07 CN disclosed
CN-111378184-A Energy absorption method based on dynamic polymer 翁秋梅 2020-07-07 CN disclosed
CN-111218021-A Vitrified dilatant polymer foam hybrid material 翁秋梅 2020-06-02 CN disclosed
CN-111150173-A Shock attenuation sole and shock attenuation shoes 翁秋梅 2020-05-15 CN disclosed
CN-105542108-A Easily-dyeable polyurethane resin used for superfine fiber synthetic leather and preparation method thereof HUAFON MICROFIBRE (SHANGHAI) CO LTD 2016-05-04 CN disclosed
US-8609076-B2 Use of particular polyols for preventing the hair from breaking, composition comprising them and cosmetic hair treatment process L'OREAL (FR) 2013-12-17 US disclosed
EP-2342766-A1 POWER LED DEVICE WITH A REFLECTOR MADE OF AROMATIC POLYESTER AND/OR WHOLLY AROMATIC POLYESTER Solvay Advanced Polymers, L.L.C. (US) 2011-07-13 EP disclosed
WO-2010049531-A1 POWER LED DEVICE WITH A REFLECTOR MADE OF AROMATIC POLYESTER AND/OR WHOLLY AROMATIC POLYESTER SOLVAY ADVANCED POLYMERS, L.L.C. (US) 2010-05-06 WO disclosed
US-20060039879-A1 Use of particular polyols for preventing the hair from breaking, composition comprising them and cosmetic hair treatment process L'OREAL (FR) 2006-02-23 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 (1 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-20060039879-A1 Use of particular polyols for preventing the hair from breaking, composition comprising them and cosmetic hair treatment process CUTA, POLR1C, NACA ALDH1A1 1548/4885HPGD 1666/4885POLB 239/4885

“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.