SCHEMBL352023

SCHEMBL352023

Nc1ccc(Cc2ccc(N)cc2Cl)c(Cl)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 4/20 0.56
TSHR P16473 3/20 0.56
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
HTT P42858 3/20 0.48
GAA P10253 3/20 0.48
MAPT P10636 2/20 0.48
MAPK1 P28482 1/20 0.48
SMN1; SMN2 Q16637 3/20 0.44
ALDH1A1 P00352 5/20 0.43
ALOX15 P16050 2/20 0.43
THRB P10828 2/20 0.43
HPGD P15428 1/20 0.43
CASP1 P29466 1/20 0.43
RECQL P46063 1/20 0.43
HSD17B10 Q99714 1/20 0.43
PDE7A Q13946 1/20 0.42
EPHX2 P34913 1/20 0.41
NR1H4 Q96RI1 1/20 0.41
POLB P06746 1/20 0.41

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
SCHEMBL31175763 1.00 CYP3A4 (0.56) CYP3A4TSHRCA1CA2HTT
SCHEMBL31175762 0.87 CYP3A4 (0.52) CYP3A4TSHRCA1CA2HTT
SCHEMBL990234 0.87 CYP3A4 (0.52) CYP3A4TSHRCA1CA2HTT
SCHEMBL11228666 0.86 CYP3A4 (0.44) CYP3A4TSHRCA1CA2HTT
SCHEMBL1149063 0.83 MAPT (0.49) CYP3A4TSHRCA1CA2HTT
SCHEMBL14268291 0.83 ALOX15 (0.46) CYP3A4TSHRHTTGAAALDH1A1
SCHEMBL8145738 0.83 TSHR (0.41) CYP3A4TSHRCA1CA2HTT
SCHEMBL14085077 0.83 CYP3A4 (0.54) CYP3A4TSHRCA1CA2HTT
SCHEMBL6676181 0.81 TAAR1 (0.56) CYP3A4TSHRCA1CA2ALDH1A1
SCHEMBL1299722 0.81 CYP3A4 (0.52) CYP3A4TSHRCA1CA2HTT

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 1055 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118344549-A Polyurethane damping material and preparation method and application thereof 上海华峰新材料研发科技有限公司 2024-07-16 CN claimed
CN-118342701-A Low-defect polishing pad and preparation method thereof 万华化学集团电子材料有限公司 2024-07-16 CN claimed
CN-118325350-A Warm-mix high-viscosity asphalt and preparation method thereof 山西省交通科技研发有限公司 2024-07-12 CN claimed
CN-118184956-A Preparation method of heat-resistant polyurethane foam material 攀枝花钢城集团有限公司 2024-06-14 CN claimed
CN-118085558-A Nylon 66 composition and preparation method thereof 上海金发科技发展有限公司 2024-05-28 CN claimed
CN-118048103-A Polyurethane elastomer coating layer for guide wheel and preparation method thereof 乐山高测新能源科技有限公司 2024-05-17 CN claimed
CN-117986848-A Pultruded polyurethane door and window composite material and preparation method thereof 河北聚久复合材料有限公司 2024-05-07 CN claimed
CN-117947645-A Tectorial membrane anti-corrosion steel strand and application and preparation process thereof 天津市春鹏预应力钢绞线有限公司 2024-04-30 CN claimed
CN-117467105-B Bio-based solvent-resistant polyurethane prepolymer and preparation method and application thereof 山东一诺威聚氨酯股份有限公司 2024-04-23 CN claimed
CN-117903510-A Caster material and preparation method thereof 中山市飞达脚轮有限公司 2024-04-19 CN claimed
US-20030225240-A1 Modified urethane compositions containing adducts of O-phthalic anhydride ester polyols UNIROYAL CHEMICAL COMPANY, INC. 2003-12-04 US claimed
WO-2003091306-A1 POLYURETHANE ELASTOMERS FROM HDI PREPOLYMERS WITH REDUCED CONTENT OF FREE HDI MONOMERS CROMPTON CORPORATION (US) 2003-11-06 WO claimed
US-20030203771-A1 Polyurethane elastomers from HDI prepolymers with reduced content of free HDI monomers CROMPTON CORPORATION 2003-10-30 US claimed
US-20030055192-A1 High friction polyurethane elastomers having improved abrasion resistance CHEMTURA USA CORPORATION 2003-03-20 US claimed
WO-2002004536-A2 MODIFIED URETHANE COMPOSITIONS CONTAINING ADDUCTS OF O-PHTHALIC ANHYDRIDE ESTER POLYOLS UNIROYAL CHEMICAL COMPANY, INC. (US) 2002-01-17 WO claimed
EP-0982079-A2 Method for producing cylindrical objects with multilayer coatings having dissimilar compositions without interfaces UNIROYAL CHEMICAL COMPANY, Inc. (US) 2000-03-01 EP claimed
US-6027769-A Method for producing cylindrical objects of multilayer dissimilar compositions without interfaces CHEMTURA USA CORPORATION 2000-02-22 US claimed
EP-0897401-B1 POLYURETHANE COMPOSITION USEFUL FOR COATING CYLINDRICAL PARTS UNIROYAL CHEM CO INC (US) 2000-01-26 EP claimed
US-5895806-A ISOCYANATE-TERMINATED POLYURETHANE PREPOLYMER CURABLE WITH CURING AGENT MIXTURE COMPRISING A POLYOL, AN AROMATIC DIAMINE, A THIXOTROPIC ALIPHATIC AMINE AND A THIXOTROPIC COLLOIDAL ADDITIVE; SYNERGISTIC, NONDRIPPING UNIROYAL CHEMICAL COMPANY, INC. (US) 1999-04-20 US claimed
US-5895689-A ROTATIONAL CASTING ONTO A CYLINDER AN ISOCYANATE-TERMINATED POLYURETHANE PREPOLYMER CURED WITH NONDRIPPING MIXTURE COMPRISING A POLYOL, AN AROMATIC DIAMINE, A THIXOTROPIC ALIPHATIC AMINE AND A THIXOTROPIC COLLOIDAL ADDITIVE UNIROYAL CHEMICAL COMPANY, INC. (US) 1999-04-20 US claimed