SCHEMBL607777

SCHEMBL607777

C=CCN(C(C)C(=O)O)C(C)C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.35
KMT2A Q03164 3/20 0.35
MEN1 O00255 2/20 0.35
KDM4E B2RXH2 1/20 0.33
LMNA P02545 1/20 0.33
TSHR P16473 1/20 0.32
TP53 P04637 1/20 0.32
GRIK1 P39086 2/20 0.31
GRIK2 Q13002 2/20 0.31
SMPD2 O60906 1/20 0.31
DPP4 P27487 1/20 0.31
CYP2C19 P33261 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
SCHEMBL2550190 0.82 SMPD2 (0.41) ALDH1A1KMT2AMEN1KDM4ELMNA
SCHEMBL11151572 0.80 ALDH1A1 (0.34) ALDH1A1KMT2AMEN1KDM4ELMNA
SCHEMBL28106794 0.80 TP53 (0.36) ALDH1A1KMT2AMEN1KDM4ELMNA
SCHEMBL437392 0.80 ALDH1A1 (0.34) ALDH1A1KMT2AMEN1KDM4ELMNA
SCHEMBL500664 0.78 KMT2A (0.33) ALDH1A1KMT2AMEN1KDM4ELMNA
Hydrochloric Acid SCHEMBL27738300 0.78 KMT2A (0.33) ALDH1A1KMT2AMEN1KDM4ELMNA
SCHEMBL500663 0.78 KMT2A (0.33) ALDH1A1KMT2AMEN1KDM4ELMNA
SCHEMBL27505903 0.77 KMT2A (0.33) ALDH1A1KMT2AMEN1KDM4ESMPD2
SCHEMBL27669545 0.77 KMT2A (0.33) ALDH1A1KMT2AMEN1KDM4E
SCHEMBL12894099 0.75 KMT2A (0.32) ALDH1A1KMT2AMEN1KDM4EDPP4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3387100-A1 PRESSED MANUAL DISH DETERGENT Ecolab USA Inc. (US) 2018-10-17 EP claimed
WO-2017100267-A1 PRESSED MANUAL DISH DETERGENT ECOLAB USA INC. (US) 2017-06-15 WO claimed
EP-0127580-A2 Mixtures of quaternary polymeric ammonium salts and of a ternary surfactant system based on non ionic, anionic and amphoteric surfactants, its preparation and its use in cosmetic compositions CIBA-GEIGY AG (CH) 1984-12-05 EP claimed
US-20230111600-A1 POLYMERIC FATTY ACID COMPOUNDS FOR THE TREATMENT OF FIBROUS AMINO ACID-BASED SUBSTRATES, ESPECIALLY HAIR MOMENTIVE PERFORMANCE MAT GMBH (DE) 2023-04-13 US disclosed
US-20230102191-A1 NONIONIC POLYMERIC FATTY ACID COMPOUNDS FOR THE TREATMENT OF FIBROUS AMINO ACID-BASED SUBSTRATES, ESPECIALLY HAIR MOMENTIVE PERFORMANCE MAT GMBH (DE) 2023-03-30 US disclosed
EP-4077269-A1 POLYMERIC FATTY ACID COMPOUNDS FOR THE TREATMENT OF FIBROUS AMINO ACID-BASED SUBSTRATES, ESPECIALLY HAIR Momentive Performance Materials GmbH (DE) 2022-10-26 EP disclosed
WO-2021123904-A1 POLYMERIC FATTY ACID COMPOUNDS FOR THE TREATMENT OF FIBROUS AMINO ACID-BASED SUBSTRATES, ESPECIALLY HAIR MOMENTIVE PERFORMANCE MATERIALS GMBH (DE) 2021-06-24 WO disclosed
EP-3484960-B1 LOW VISCOSITY POLYORGANOSILOXANES COMPRISING QUATERNARY AMMONIUM GROUPS, METHODS FOR THE PRODUCTION AND THE USE THEREOF MOMENTIVE PERFORMANCE MAT GMBH (DE) 2020-12-09 EP disclosed
EP-2831178-B1 LOW VISCOSITY POLYORGANOSILOXANES COMPRISING QUATERNARY AMMONIUM GROUPS, METHODS FOR THE PRODUCTION AND THE USE THEREOF (ll) MOMENTIVE PERFORMANCE MAT GMBH (DE) 2020-07-22 EP disclosed
EP-3199592-B1 LOW VISCOSITY POLYORGANOSILOXANES COMPRISING QUATERNARY AMMONIUM GROUPS, METHODS FOR THE PRODUCTION AND THE USE THEREOF MOMENTIVE PERFORMANCE MAT GMBH (DE) 2020-02-26 EP disclosed
EP-3357973-B1 LOW VISCOSITY POLYORGANOSILOXANES COMPRISING QUATERNARY AMMONIUM GROUPS, METHODS FOR THE PRODUCTION AND THE USE THEREOF (II) MOMENTIVE PERFORMANCE MAT GMBH (DE) 2019-07-31 EP disclosed
WO-2002010256-A1 MONO- OR POLY-QUATERNARY POLYSILOXANES GE BAYER SILICONES GMBH & CO. KG (DE) 2002-02-07 WO disclosed
US-5753748-A MONOMER VEHICLE CONTAINING ATLEAST ONE POLYISOCYANTE ESTER MONOMER, CATIONIC SURFACTANTS AND METAL CATALYSTS QUANTUM MATERIALS, INC. (US) 1998-05-19 US disclosed
US-5718941-A FOR ADHESIVE COMPOSITIONS QUANTUM MATERIALS, INC. (US) 1998-02-17 US disclosed
EP-0584227-A1 HERBICIDAL SUBSTITUTED CYCLOHEXANEDIONE AND NITROGEN FERTILISER COMPOSITIONS AND METHOD. ZENECA LTD (GB) 1994-03-02 EP disclosed
EP-0487903-B1 PROCESS FOR THE PREPARATION OF 1,3 PROPANEDIOL Degussa Aktiengesellschaft (DE) 1993-04-14 EP disclosed
EP-0487903-A2 Process for the preparation of 1,3 propanediol Degussa Aktiengesellschaft (DE) 1992-06-03 EP disclosed
EP-0127580-A2 Mixtures of quaternary polymeric ammonium salts and of a ternary surfactant system based on non ionic, anionic and amphoteric surfactants, its preparation and its use in cosmetic compositions CIBA-GEIGY AG (CH) 1984-12-05 EP disclosed
US-4181634-A Mild cleansing compositions comprising an alkyleneoxylated bisquaternary ammonium compound and an anionic or amphoteric detergent such as a phosphobetaine JOHNSON & JOHNSON (US) 1980-01-01 US disclosed
US-4110263-A ANIONIC OR AMPHOTERIC DETERGENT JOHNSON & JOHNSON BABY PRODUCTS COMPANY (US) 1978-08-29 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 (2 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-20230111600-A1 POLYMERIC FATTY ACID COMPOUNDS FOR THE TREATMENT OF FIBROUS AMINO ACID-BASED SUBSTRATES, ESPECIALLY HAIR QARS1, FFAR3, ELOVL1 ALDH1A1 2332/4885KMT2A 1310/4885MEN1 3102/4885
US-20230102191-A1 NONIONIC POLYMERIC FATTY ACID COMPOUNDS FOR THE TREATMENT OF FIBROUS AMINO ACID-BASED SUBSTRATES, ESPECIALLY HAIR ELOVL3, ELOVL1, FIBP ALDH1A1 1548/4885KMT2A 2957/4885MEN1 3756/4885

“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.