SCHEMBL500671

SCHEMBL500671

OCC(O)Cc1ccccc1Oc1ccccc1CC(O)CO

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 3/20 0.44
KDM4E B2RXH2 2/20 0.44
AGTR1 P30556 1/20 0.44
LMNA P02545 1/20 0.44
MEN1 O00255 1/20 0.42
CYP2C19 P33261 1/20 0.42
KMT2A Q03164 1/20 0.42
CXCL8 P10145 2/20 0.39
SCN9A Q15858 3/20 0.37
PPARA Q07869 1/20 0.37
SLC6A2 P23975 2/20 0.36
SLC6A4 P31645 2/20 0.36
SLC6A3 Q01959 1/20 0.36

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
SCHEMBL7506347 0.85 LMNA (0.59) CYP1A2KDM4EAGTR1LMNA
SCHEMBL7506353 0.85 LMNA (0.59) CYP1A2KDM4EAGTR1LMNA
SCHEMBL30480678 0.83 CYP3A4 (0.41) CYP1A2KDM4EAGTR1LMNAMEN1
SCHEMBL28177618 0.83 CYP3A4 (0.41) CYP1A2KDM4EAGTR1LMNAMEN1
SCHEMBL27486127 0.82 ALDH1A1 (0.50) CYP1A2KDM4EAGTR1LMNAMEN1
SCHEMBL1773434 0.80 CYP1A2 (0.39) CYP1A2KDM4EAGTR1LMNAMEN1
SCHEMBL1491279 0.79 INPPL1 (0.44) CYP1A2KDM4EAGTR1LMNAMEN1
SCHEMBL28192016 0.79 SLC6A2 (0.47) CYP1A2KDM4EAGTR1LMNAMEN1
SCHEMBL16797585 0.79 HTR1A (0.56) KDM4ELMNAMEN1KMT2A
SCHEMBL16809470 0.78 CYP1A2 (0.47) CYP1A2KDM4EAGTR1LMNACYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2854751-B1 USE OF N-METHYL-N-ACYLGLUCAMINES AS SOLUBILIZERS CLARIANT INT LTD (CH) 2016-08-10 EP claimed
EP-1339792-B1 SURFACTANT-CONTAINING COSMETIC, DERMATOLOGICAL AND PHARMACEUTICAL AGENTS CLARIANT PRODUKTE DEUTSCHLAND (DE) 2015-02-25 EP claimed
EP-2297060-B1 RHEOLOGY INFLUENCING ADDITIVE FOR MINERAL BUILDING MATERIALS AKZO NOBEL NV (NL) 2013-10-09 EP claimed
CN-102007084-B Rheology influencing additive for mineral building materials AKZO NOBEL NV 2013-10-09 CN claimed
EP-2634152-A1 Rheology influencing additive for mineral building materials Akzo Nobel N.V. (NL) 2013-09-04 EP claimed
US-8187581-B2 Copolymers from acryloyldimethyltaurine or an acryloyldimethyltaurate, olefinically unsaturated, noncationic, crosslinking comonomer, olefinically unsaturated, cationic comonomer having oxygen, nitrogen, sulfur or phosphorus, silicon-containing component, macromonomer having oxygen, nitrogen, sulfur CLARIANT PRODUKTE (DEUTSCHLAND) GMBH (DE) 2012-05-29 US claimed
CN-102007084-A Rheology influencing additive for mineral building materials AKZO NOBEL NV 2011-04-06 CN claimed
EP-2297060-A1 RHEOLOGY INFLUENCING ADDITIVE FOR MINERAL BUILDING MATERIALS Akzo Nobel N.V. (NL) 2011-03-23 EP claimed
US-20110039984-A1 RHEOLOGY INFLUENCING ADDITIVE FOR MINERAL BUILDING MATERIALS AKZO NOBEL N.V. (NL) 2011-02-17 US claimed
WO-2009144081-A1 RHEOLOGY INFLUENCING ADDITIVE FOR MINERAL BUILDING MATERIALS AKZO NOBEL N.V. (NL) 2009-12-03 WO claimed
US-20080107617-A1 Surfactant-containing cosmetic, dermatological and pharmaceutical agents CLARIANT PRODUKTE (DEUTSCHLAND) GMBH 2008-05-08 US claimed
US-7332155-B2 Surfactant-containing cosmetic, dermatological and pharmaceutical agents CLARIANT PRODUKTE (DEUTSCHLAND) GMBH (DE) 2008-02-19 US claimed
US-6946139-B2 Methods for producing foam from multiphase compositions CLARIANT GMBH (DE) 2005-09-20 US claimed
US-20040141937-A1 comprising comb copolymers based on acryloyldimethyltaurine CLARIANT GMBH (DE) 2004-07-22 US claimed
US-20040105825-A1 Methods for producing foam from multiphase compositions CLARIANT GMBH 2004-06-03 US claimed
CN-118355099-A Hand dishwashing composition containing ethoxylated glycerides 科莱恩国际有限公司 2024-07-16 CN disclosed
US-12023309-B2 Enhanced delivery epinephrine compositions AQUESTIVE THERAPEUTICS, INC. (US) 2024-07-02 US disclosed
US-4261924-A FUNGICIDES, BACTERICIDES BASF AKTIENGESELLSCHAFT (DE) 1981-04-14 US disclosed
US-4185106-A Pyridones as antidandruff agents HOECHST AKTIENGESELLSCHAFT (DE) 1980-01-22 US disclosed
US-4180084-A HAIR-CARE, ESPECIALLY SHAMPOO CIBA-GEIGY CORPORATION (US) 1979-12-25 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-20040141937-A1 comprising comb copolymers based on acryloyldimethyltaurine ATIC, PCNA, FEN1 CYP1A2 1962/4885KDM4E 3877/4885AGTR1 4130/4885
US-20080107617-A1 Surfactant-containing cosmetic, dermatological and pharmaceutical agents SGMS1, SUCLG1, SGMS2 CYP1A2 2139/4885KDM4E 4522/4885AGTR1 3619/4885

“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.