SCHEMBL1404023

SCHEMBL1404023

OCCCCCCN1CCCCC1

nearest known ligand 0.75

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 7/20 0.75
CYP1A2 P05177 1/20 0.50
MAPK1 P28482 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
ALDH1A1 P00352 4/20 0.47
MAPT P10636 3/20 0.47
ALOX15 P16050 1/20 0.47
SIGMAR1 Q99720 2/20 0.47
CXCR4 P61073 1/20 0.43
POLB P06746 1/20 0.43
TSHR P16473 1/20 0.42

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
SCHEMBL11859421 1.00 HRH3 (0.75) HRH3CYP1A2MAPK1SMN1; SMN2ALDH1A1
SCHEMBL9158672 1.00 HRH3 (0.75) HRH3CYP1A2MAPK1SMN1; SMN2ALDH1A1
SCHEMBL1404029 1.00 HRH3 (0.75) HRH3CYP1A2MAPK1SMN1; SMN2ALDH1A1
SCHEMBL7374716 1.00 HRH3 (0.75) HRH3CYP1A2MAPK1SMN1; SMN2ALDH1A1
SCHEMBL1404041 1.00 HRH3 (0.75) HRH3CYP1A2MAPK1SMN1; SMN2ALDH1A1
SCHEMBL1403869 1.00 HRH3 (0.75) HRH3CYP1A2MAPK1SMN1; SMN2ALDH1A1
SCHEMBL1404107 1.00 HRH3 (0.75) HRH3CYP1A2MAPK1SMN1; SMN2ALDH1A1
SCHEMBL4504898 0.97 HRH3 (0.70) HRH3CYP1A2MAPK1SMN1; SMN2ALDH1A1
SCHEMBL9078 0.97 HRH3 (0.70) HRH3CYP1A2MAPK1SMN1; SMN2ALDH1A1
SCHEMBL1403845 0.97 HRH3 (0.70) HRH3CYP1A2MAPK1SMN1; SMN2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103459359-A Polyols and their use in hydrocarbon lubricating and drilling fluids LORD CORP 2013-12-18 CN claimed
EP-2670726-A1 POLYOLS AND THEIR USE IN HYDROCARBON LUBRICATING AND DRILLING FLUIDS Lord Corporation (US) 2013-12-11 EP claimed
EP-1399409-B1 METHOD FOR PRODUCING (METH)ACRYLIC ACID ESTERS BASF SE (DE) 2012-10-31 EP claimed
US-20120202723-A1 POLYOLS AND THEIR USE IN HYDROCARBON LUBRICATING AND DRILLING FLUIDS LORD CORPORATION 2012-08-09 US claimed
WO-2012106597-A1 POLYOLS AND THEIR USE IN HYDROCARBON LUBRICATING AND DRILLING FLUIDS LORD CORPORATION (US) 2012-08-09 WO claimed
CN-100349854-C Method for producing (meth) acrylic acid esters BASF AG (DE) 2007-11-21 CN claimed
CN-100349851-C Method for producing acrylic acid esters BASF AG (DE) 2007-11-21 CN claimed
US-7026503-B2 Method for producing (meth)acrylic acid esters BASF AKTIENGESELLSCHAFT (DE) 2006-04-11 US claimed
EP-1399408-B1 METHOD FOR PRODUCING (METH)ACRYLIC ACID ESTERS BASF AG (DE) 2006-03-22 EP claimed
EP-0662834-A4 NOVEL EPOXIDE-CONTAINING COMPOUNDS. CELL THERAPEUTICS INC (US) 1996-04-17 EP claimed
EP-0662834-A1 NOVEL EPOXIDE-CONTAINING COMPOUNDS CELL THERAPEUTICS, INC. (US) 1995-07-19 EP claimed
WO-1994006431-A1 NOVEL EPOXIDE-CONTAINING COMPOUNDS CELL THERAPEUTICS, INC. (US) 1994-03-31 WO claimed
US-20230320995-A1 IONIZABLE CATIONIC LIPIDS AND LIPID NANOPARTICLES CAPSTAN THERAPEUTICS, INC. (US) 2023-10-12 US disclosed
US-20230320995-A1 IONIZABLE CATIONIC LIPIDS AND LIPID NANOPARTICLES CAPSTAN THERAPEUTICS, INC. (US) 2023-10-12 US disclosed
US-10174349-B2 Recombinant cell producing 2-hydroxyisobutyric acid EVONIK ROEHM GMBH (DE) 2019-01-08 US disclosed
EP-2291530-B1 RECOMBINANT CELL PRODUCING 2-HYDROXYISOBUTYRIC ACID EVONIK ROEHM GMBH (DE) 2018-12-26 EP disclosed
WO-1993022302-A1 N-ARYLOXY(THIO)ALKYL-AZACYCLOALKANES USEFUL AS CALCIUM CHANNEL ANTAGONISTS SMITHKLINE BEECHAM PLC (GB) 1993-11-11 WO disclosed
US-4820717-A Antimicrobial aromatic derivatives substituted by an (omega amino) alkanol group and compositions containing them SANOFI (FR) 1989-04-11 US disclosed
EP-0289262-A2 Omega-quaternary ammonium alkyl esters and thioesters of acidic nonsteroidal antiinflammatory drugs SYNTEX PHARMACEUTICALS INTERNATIONAL LIMITED (BM) 1988-11-02 EP disclosed
US-4455168-A CONTAINING A HETEROCYCLIC, HYDROXY AMINE OR AMIDE RICOH COMPANY, LTD. (JP) 1984-06-19 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-20120202723-A1 POLYOLS AND THEIR USE IN HYDROCARBON LUBRICATING AND DRILLING FLUIDS SCD, MRE11, POLH HRH3 902/4885CYP1A2 725/4885MAPK1 1717/4885
US-20230320995-A1 IONIZABLE CATIONIC LIPIDS AND LIPID NANOPARTICLES PLTP, LNPEP, PLIN3 HRH3 2171/4885CYP1A2 4878/4885MAPK1 4305/4885

“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.