SCHEMBL3476979

SCHEMBL3476979

CCCCCCCCCCCCCCCCCCNCC=CN

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 5/20 0.56
TSHR P16473 2/20 0.50
ALDH1A1 P00352 1/20 0.50
EPHX1 P07099 2/20 0.46
ADH1B P00325 2/20 0.46
ADH1C P00326 2/20 0.46
ADH1A P07327 2/20 0.46
ADH7 P40394 2/20 0.46
ADH4 P08319 1/20 0.46
PPARA Q07869 1/20 0.39
S1PR2 O95136 5/20 0.38
S1PR4 O95977 5/20 0.38
S1PR1 P21453 5/20 0.38
S1PR3 Q99500 5/20 0.38
S1PR5 Q9H228 1/20 0.38
ANPEP P15144 1/20 0.38
ERAP2 Q6P179 1/20 0.38

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
SCHEMBL10827259 1.00 KDM1A (0.56) KDM1ATSHRALDH1A1EPHX1ADH1B
SCHEMBL8428945 1.00 KDM1A (0.56) KDM1ATSHRALDH1A1EPHX1ADH1B
SCHEMBL8424536 1.00 KDM1A (0.56) KDM1ATSHRALDH1A1EPHX1ADH1B
SCHEMBL10943302 1.00 KDM1A (0.56) KDM1ATSHRALDH1A1EPHX1ADH1B
SCHEMBL5669166 0.98 TSHR (0.52) KDM1ATSHRALDH1A1EPHX1ADH1B
SCHEMBL7037260 0.92 PPARA (0.50) KDM1ATSHRALDH1A1PPARA
SCHEMBL17734071 0.81
SCHEMBL8424809 0.81 KDM1A (0.59) KDM1ATSHRALDH1A1EPHX1ADH1B
SCHEMBL24157573 0.80 KDM1A (0.64) KDM1ATSHRALDH1A1EPHX1ADH1B
SCHEMBL22157514 0.80 KDM1A (0.58) KDM1ATSHRALDH1A1EPHX1ADH1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1499790-B1 THICKENED ACID COMPOSITIONS AND USES THEREOF AKZO NOBEL NV (NL) 2005-11-16 EP claimed
US-4606844-A Fluorochlorohydrocarbon/phosphoric acid ester/carboxylic acid drying compositions CHLOE CHIMIE (FR) 1986-08-19 US claimed
EP-1418253-B1 Scale and corrosion inhibitor composition and process for water circuits BK GIULINI GMBH (DE) 2010-07-07 EP disclosed
EP-1418253-A1 Scale and corrosion inhibitor composition and process for water circuits Concorde Chimie (FR) 2004-05-12 EP disclosed
EP-1129038-B1 COMPOSITION INHIBITING PIPE SCALING AND CORROSION IN A WATER SUPPLY SYSTEM CONCORDE CHIMIE (FR) 2003-04-02 EP disclosed
EP-1045045-B1 Composition and process for the conditioning of water for industrial use FABORGA SA (CH) 2003-03-26 EP disclosed
EP-1129038-A1 COMPOSITION INHIBITING PIPE SCALING AND CORROSION IN A WATER SUPPLY SYSTEM Concorde Chimie France (FR) 2001-09-05 EP disclosed
EP-1045045-A1 Composition and process for the conditioning of water for industrial use FABORGA S.A. (CH) 2000-10-18 EP disclosed
WO-1999067177-A1 COMPOSITION INHIBITING PIPE SCALING AND CORROSION IN A WATER SUPPLY SYSTEM CONCORDE CHIMIE FRANCE (FR) 1999-12-29 WO disclosed
EP-0774017-B1 SCALE AND CORROSION INHIBITING COMPOSITION FOR PROTECTING SURFACES IN CONTACT WITH WATER AND METHOD FOR THE PREPARATION OF SAID COMPOSITION CONCORDE CHIMIE FRANCE (FR) 1999-10-27 EP disclosed
EP-0774017-A1 SCALE AND CORROSION INHIBITING COMPOSITION FOR PROTECTING SURFACES IN CONTACT WITH WATER AND METHOD FOR THE PREPARATION OF SAID COMPOSITION Concorde Chimie France (FR) 1997-05-21 EP disclosed
US-4276089-A WATER INSOLUBLE POLYAMINES AND AMINOALKYLENE PHOSPHONIC ACID DERIVATIVES UNION CHIMIQUE ET INDUSTRIELLE DE L'OUEST S.A. (FR) 1981-06-30 US disclosed
EP-0010485-A1 Corrosion inhibitor composition, process for its preparation and its use in protecting metal surfaces UNION CHIMIQUE ET INDUSTRIELLE DE L'OUEST S.A. Société anonyme dite: (FR) 1980-04-30 EP disclosed
US-4161450-A TRICHLOROTRIFLUOROETHANE, HYDROPHOBIC SURFACTANT, ORGANIC ACID RHONE-POULENC INDUSTRIES (FR) 1979-07-17 US disclosed
US-4058607-A DIHALOVINYL DIALKYL PHOSPHATE, 1,3-BENZODIOXOLES AIRWICK INDUSTRIES, INC. (US) 1977-11-15 US disclosed
US-4037353-A Device for emitting vapors of active substance AIRWICK INDUSTRIES, INC. (US) 1977-07-26 US disclosed
US-4037352-A PYRETHRINOIDS AIRWICK INDUSTRIES, INC. (US) 1977-07-26 US disclosed
US-3976769-A INSECTICIDE AIRWICK INDUSTRIES, INC. (US) 1976-08-24 US disclosed
US-3966900-A INSECTICIDES AIRWICK INDUSTRIES, INC. (US) 1976-06-29 US disclosed
US-3962415-A Insecticide evaporator comprising DDVP with synergized benzodioxole compound as stabilizer AIRWICK INDUSTRIES, INC. (US) 1976-06-08 US disclosed