SCHEMBL10012596

SCHEMBL10012596

CC(C)(C)c1ccc(N([C]=O)c2ccc(C(C)(C)C)cc2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.42
LMNA P02545 3/20 0.41
TYR P14679 1/20 0.41
ALDH1A1 P00352 5/20 0.39
KIF11 P52732 2/20 0.38
HSD17B10 Q99714 2/20 0.38
HDAC1 Q13547 1/20 0.38
RARB P10826 1/20 0.37
RARG P13631 1/20 0.37
SRD5A2 P31213 1/20 0.36
NR1H4 Q96RI1 1/20 0.36
CYP1A2 P05177 2/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA9 Q16790 1/20 0.35
GAA P10253 1/20 0.35
MEN1 O00255 2/20 0.35
RAB9A P51151 2/20 0.35
KMT2A Q03164 2/20 0.35
NPSR1 Q6W5P4 2/20 0.35

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
SCHEMBL5543096 0.80 TSHR (0.41) TSHRLMNATYRALDH1A1KIF11
SCHEMBL14471532 0.77 GABRA1 (0.41) GAAMAPTKDM4ECYP2C19
SCHEMBL6553741 0.73 ALDH1A1 (0.58) TSHRALDH1A1HSD17B10CA1CA2
SCHEMBL2140337 0.73 ALDH1A1 (0.48) TSHRLMNAALDH1A1CA1CA2
SCHEMBL6705565 0.72 TSHR (0.52) TSHRLMNATYRALDH1A1KIF11
SCHEMBL14163841 0.72 TSHR (0.52) TSHRLMNATYRALDH1A1KIF11
SCHEMBL13136660 0.72 TSHR (0.52) TSHRLMNATYRALDH1A1KIF11
SCHEMBL424728 0.71 TSHR (0.73) TSHRLMNATYRALDH1A1KIF11
SCHEMBL15494 0.70 TSHR (0.61) TSHRLMNATYRALDH1A1HSD17B10
SCHEMBL1134090 0.70 TSHR (0.50) TSHRLMNATYRALDH1A1KIF11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2478981-B1 SILVER-(CONJUGATED COMPOUND) COMPLEX SUMITOMO CHEMICAL CO (JP) 2020-12-23 EP disclosed
US-9704612-B2 Composition of silver-conjugated compound composite SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-07-11 US disclosed
US-9412487-B2 Silver-(conjugated compound) composite SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2016-08-09 US disclosed
US-20140001422-A1 COMPOSITION OF SILVER-CONJUGATED COMPOUND COMPOSITE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2014-01-02 US disclosed
EP-2478981-A1 SILVER-(CONJUGATED COMPOUND) COMPLEX Sumitomo Chemical Co., Ltd (JP) 2012-07-25 EP disclosed
US-20120168693-A1 SILVER-(CONJUGATED COMPOUND) COMPOSITE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-07-05 US disclosed