SCHEMBL2129584

SCHEMBL2129584

CCCCCCCCCCCCCCCCCCNC(CC)N(C)C

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 6/20 0.46
TSHR P16473 2/20 0.39
ALDH1A1 P00352 1/20 0.39
ADH1B P00325 1/20 0.37
ADH1C P00326 1/20 0.37
ADH1A P07327 1/20 0.37
ADH4 P08319 1/20 0.37
ADH7 P40394 1/20 0.37
DNM1 Q05193 4/20 0.36
THRB P10828 1/20 0.35
S1PR2 O95136 5/20 0.34
S1PR4 O95977 5/20 0.34
S1PR1 P21453 5/20 0.34
S1PR3 Q99500 5/20 0.34
S1PR5 Q9H228 1/20 0.34

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
SCHEMBL8410933 1.00 EPHX1 (0.46) EPHX1TSHRALDH1A1ADH1BADH1C
SCHEMBL22631540 1.00 EPHX1 (0.46) EPHX1TSHRALDH1A1ADH1BADH1C
SCHEMBL28459714 1.00 EPHX1 (0.46) EPHX1TSHRALDH1A1ADH1BADH1C
SCHEMBL28318346 1.00 EPHX1 (0.46) EPHX1TSHRALDH1A1ADH1BADH1C
SCHEMBL27443494 1.00 EPHX1 (0.46) EPHX1TSHRALDH1A1ADH1BADH1C
SCHEMBL19894618 1.00 EPHX1 (0.46) EPHX1TSHRALDH1A1ADH1BADH1C
Hydrochloric Acid SCHEMBL28625841 0.98 EPHX1 (0.44) EPHX1TSHRALDH1A1ADH1BADH1C
Hydrochloric Acid SCHEMBL29020790 0.98 EPHX1 (0.44) EPHX1TSHRALDH1A1ADH1BADH1C
Water SCHEMBL28739412 0.98 EPHX1 (0.44) EPHX1TSHRALDH1A1ADH1BADH1C
Bromide SCHEMBL29068638 0.98 EPHX1 (0.44) EPHX1TSHRALDH1A1ADH1BADH1C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1639311-B Mixtures of quaternary compounds CRODA INC 2010-05-12 CN claimed
US-6120757-A COSMETICS; THERAPY FOR SKIN DISORDERS, HAIR SOCIETE L'OREAL S.A. (FR) 2000-09-19 US claimed
EP-4366690-B1 POLYOL ESTER MIXTURE FOR USE AS VASELINE SUBSTITUTE BASF SE (DE) 2025-06-25 EP disclosed
CN-119546274-A Composition comprising a peroxo salt, a specific content of fatty substances, an amino acid type compound and a specific (poly) carboxylic acid 莱雅公司 2025-02-28 CN disclosed
CN-119486706-A Composition comprising a peroxo salt, a hydrocarbon with a melting point of 85 ℃ or higher and at least 10% fatty substances 莱雅公司 2025-02-18 CN disclosed
CN-119421694-A Composition comprising a peroxo salt, an associative polymer, a non-associative polysaccharide and a hydrocarbon having a melting point greater than 25 DEG C 莱雅公司 2025-02-11 CN disclosed
CN-119421695-A Composition comprising a peroxo salt, a hydrocarbon having a melting point of more than 25 ℃, and an amino acid type compound 莱雅公司 2025-02-11 CN disclosed
US-20240325268-A1 POLYOL ESTER MIXTURE FOR USE AS VASELINE SUBSTITUTE BASF SE (DE) 2024-10-03 US disclosed
EP-4366690-A1 POLYOL ESTER MIXTURE FOR USE AS VASELINE SUBSTITUTE BASF SE (DE) 2024-05-15 EP disclosed
CN-117715615-A Composition comprising at least one oxidation dye, 1, 3-propanediol, at least one alkaline agent and at least one fatty substance 莱雅公司 2024-03-15 CN disclosed
CN-117642151-A Polyol ester mixtures as petrolatum substitutes 巴斯夫欧洲公司 2024-03-01 CN disclosed
US-20050215449-A1 Textile care product HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (HENKEL KGAA) (DE) 2005-09-29 US disclosed
CN-1674858-A Hair cleansing composition KAO CORP (JP) 2005-09-28 CN disclosed
CN-1671346-A Detergent compositions KAO CORP (JP) 2005-09-21 CN disclosed
CN-1671355-A Hair cleansing composition KAO CORP (JP) 2005-09-21 CN disclosed
CN-1639311-A Mixtures of quaternary compounds CRODA INC (US) 2005-07-13 CN disclosed
EP-0966946-B1 Cosmetic composition at least containing a branched sulfonic polyester and a conditioning agent OREAL (FR) 2004-11-10 EP disclosed
CN-1158063-C Rinse-off water-in-oil-in-water compositions ˹��������ͼ˹�����µ� 2004-07-21 CN disclosed
CN-1391457-A Method and agents for permanently shaping keratin fibres SCHWARZKOPF GMBH HANS (DE) 2003-01-15 CN disclosed
WO-1998053836-A1 IMPROVED GELLED OXYGEN PRODUCTS ANDERSON MICHAEL R (US) 1998-12-03 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 (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-20240325268-A1 POLYOL ESTER MIXTURE FOR USE AS VASELINE SUBSTITUTE FASN, DEGS1, ACSL1 EPHX1 1856/4885TSHR 4877/4885ALDH1A1 3744/4885

“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.