SCHEMBL8468137

SCHEMBL8468137

CC(C)(C)c1ccc([O])c2ccccc12

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.38
TSHR P16473 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
KIF11 P52732 1/20 0.37
CA2 P00918 1/20 0.34
ELANE P08246 2/20 0.32
GABRA1 P14867 1/20 0.30
GABRB2 P47870 1/20 0.30
NPSR1 Q6W5P4 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
SCHEMBL5517816 0.85 ALDH1A1 (0.48) ALDH1A1TSHRTDP1KIF11CA2
SCHEMBL18244061 0.77 KIF11 (0.37) ALDH1A1TSHRKIF11
SCHEMBL18242025 0.77 TSHR (0.33) TSHRTDP1
Naphthoquinone SCHEMBL10865359 0.77 ALDH1A1 (0.39) ALDH1A1TSHRTDP1
SCHEMBL24626778 0.74 ALDH1A1 (0.39) ALDH1A1TSHRTDP1KIF11CA2
SCHEMBL15958515 0.74 ALDH1A1 (0.39) ALDH1A1TSHRTDP1KIF11CA2
SCHEMBL7831783 0.74 CYP1A2 (0.62) ALDH1A1TSHRTDP1KIF11CA2
SCHEMBL18242504 0.74
SCHEMBL18244471 0.74 ELANE (0.35) ALDH1A1ELANENPSR1
SCHEMBL19440735 0.73 KIF11 (0.41) ALDH1A1TSHRTDP1KIF11CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10640641-B2 Curable coating compositions of silane functional polymers KING INDUSTRIES (US) 2020-05-05 US disclosed
US-20200062953-A1 CURABLE COATING COMPOSITIONS OF SILANE FUNCTIONAL POLYMERS KING INDUSTRIES 2020-02-27 US disclosed
US-20180237635-A1 CURABLE COATING COMPOSITIONS OF SILANE FUNCTIONAL POLYMERS KING INDUSTRIES 2018-08-23 US disclosed
US-9976028-B2 Curable coating compositions of silane functional polymers KING INDUSTRIES (US) 2018-05-22 US disclosed
WO-2016137881-A1 CURABLE COATING COMPOSITIONS OF SILANE FUNCTIONAL POLYMERS KING INDUSTRIES (US) 2016-09-01 WO disclosed
US-20160244606-A1 CURABLE COATING COMPOSITIONS OF SILANE FUNCTIONAL POLYMERS KING INDUSTRIES 2016-08-25 US disclosed
US-8912113-B2 Compositions of a metal amidine complex and second compound, coating compositions comprising same KING INDUSTRIES, INC. (US) 2014-12-16 US disclosed
EP-2683767-A1 COMPOSITIONS OF A METAL AMIDINE COMPLEX AND SECOND COMPOUND, COATING COMPOSITIONS COMPRISING SAME KING INDUSTRIES, INC. (US) 2014-01-15 EP disclosed
WO-2012122098-A1 COMPOSITIONS OF A METAL AMIDINE COMPLEX AND SECOND COMPOUND, COATING COMPOSITIONS COMPRISING SAME KING INDUSTRIES, INC. (US) 2012-09-13 WO disclosed
US-20120225982-A1 COMPOSITIONS OF A METAL AMIDINE COMPLEX AND SECOND COMPOUND, COATING COMPOSITIONS COMPRISING SAME KING INDUSTRIES, INC. 2012-09-06 US disclosed
EP-0835289-B1 AMINOSILANE SALTS AND SILANAMIDES OF CARBOXYLIC ACIDS AS CORROSION INHIBITORS CIBA GEIGY AG (CH) 1999-05-19 EP disclosed
US-5879436-A REACTION PRODUCT OF CARBOXYLIC ACID AND AMINOSILANE; PROTECTIVE COATINGS CIBA SPECIALTY CHEMICALS CORPORATION (US) 1999-03-09 US disclosed
EP-0835289-A1 AMINOSILANE SALTS AND SILANAMIDES OF CARBOXYLIC ACIDS AS CORROSION INHIBITORS Ciba SC Holding AG (CH) 1998-04-15 EP disclosed
US-5612093-A Titanium and zirconium complexes of carboxylic acids as corrosion inhibitors CIBA-GEIGY CORPORATION (US) 1997-03-18 US disclosed
WO-1997001606-A1 AMINOSILANE SALTS AND SILANAMIDES OF CARBOXYLIC ACIDS AS CORROSION INHIBITORS CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 1997-01-16 WO disclosed