SCHEMBL4458090

SCHEMBL4458090

CCOP(OCC)c1ccccc1C

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.38
ACHE P22303 2/20 0.38
SLC6A2 P23975 1/20 0.32
SLC6A4 P31645 1/20 0.32
SLC6A3 Q01959 1/20 0.32
GAA P10253 2/20 0.32
MAPT P10636 1/20 0.31
HTT P42858 1/20 0.31
ESR1 P03372 1/20 0.31
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 2/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA7 P43166 1/20 0.31
CA9 Q16790 1/20 0.31
DHODH Q02127 1/20 0.31
ALKBH5 Q6P6C2 1/20 0.31
FTO Q9C0B1 1/20 0.31
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL2947384 0.86 ALDH1A1 (0.33) TSHRALDH1A1
SCHEMBL8939006 0.85 LTA4H (0.35) TSHRACHETDP1
SCHEMBL4462349 0.83 TSHR (0.35) TSHRACHESLC6A2SLC6A4SLC6A3
SCHEMBL31413770 0.83 TSHR (0.38) TSHRACHESLC6A2SLC6A4SLC6A3
SCHEMBL7775590 0.83 TSHR (0.38) TSHRACHESLC6A2SLC6A4SLC6A3
SCHEMBL4459685 0.80 LTA4H (0.39) TSHRACHEMAPTKDM4EALDH1A1
SCHEMBL4455343 0.78 CYP4F2 (0.34) SLC6A2SLC6A4SLC6A3GAAMAPT
SCHEMBL10742274 0.77 ALDH1A1 (0.45) TSHRMAPTKDM4EALDH1A1MEN1
SCHEMBL4458079 0.77 MAPT (0.40) TSHRMAPT
SCHEMBL28276666 0.76 TSHR (0.32) TSHRACHETDP1CYP3A4

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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7612148-B2 Hydrogenation catalyst composition and method for hydrogenation of conjugated diene polymer TSRC CORPORATION (TW) 2009-11-03 US disclosed
US-20080146733-A1 Hydrogenation catalyst composition and method for hydrogenation of conjugated diene polymer TSRC CORPORATION (TW) 2008-06-19 US disclosed
US-6818153-B2 Photocurable thermosetting luminescent resins BURNELL-JONES PETER (AU) 2004-11-16 US disclosed
WO-2004011571-A1 PHOTOCURABLE THERMOSETTING LUMINESCENT RESINS ORION 21 A. D. PTY LTD (AU) 2004-02-05 WO disclosed
US-20030085383-A1 For use as gel coat, laminating resin, casting resin or moldable resin; photoluminescent, thermoluminescent and electroluminescent properties BURNELL-JONES PETER (AU) 2003-05-08 US disclosed
US-5410060-A Haloacetylation, carboxylation, phosphination BASF AKTIENGESELLSCHAFT (DE) 1995-04-25 US disclosed
US-4710523-A DISCOLORATION, WEAR RESISTANT SURFACE COATING, FINISHES, AND PRINTING INK BASF AKTIENGESELLSCHAFT (DE) 1987-12-01 US disclosed
US-4490559-A SYNTHESIS GAS AND A GROUP VII COMPOUND CATALYST SHELL OIL COMPANY (US) 1984-12-25 US disclosed
US-4447648-A USING SYNTHESIS GAS AND A GROUP VIII COMPOUND UNION CARBIDE CORPORATION (US) 1984-05-08 US disclosed
US-4298738-A PHOTOINITIATORS IN PHOTOPOLYMERIZABLE COATINGS AND IMKS BASF AKTIENGESELLSCHAFT (DE) 1981-11-03 US disclosed
US-4265723-A UNSATURATED POLYESTERS OR VINYL ESTERS OF POLYEPOXIDES AND A UV SENSITIZER OF AN ACYL PHOSPHINE OXIDE BASF AKTIENGESELLSCHAFT (DE) 1981-05-05 US disclosed