SCHEMBL9255939

SCHEMBL9255939

C=CC(C)(C)C(C)CCCC.N=C=O.N=C=O

nearest known ligand 0.34

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
CTSK P43235 1/20 0.33

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
SCHEMBL1284728 0.89 TSHR (0.37) TSHRSMN1; SMN2CTSK
SCHEMBL1972758 0.79 TSHR (0.35) TSHRSMN1; SMN2CTSK
SCHEMBL50318 0.79 TSHR (0.35) TSHRSMN1; SMN2CTSK
Hexane SCHEMBL28511182 0.77 DNM1 (0.34) TSHRSMN1; SMN2
SCHEMBL1285498 0.76 MEN1 (0.31)
SCHEMBL27613407 0.72 TSHR (0.46) TSHRSMN1; SMN2CTSK
SCHEMBL28153806 0.70 TSHR (0.38) TSHRSMN1; SMN2CTSK
SCHEMBL11880199 0.70 TSHR (0.38) TSHRSMN1; SMN2
SCHEMBL23825191 0.69 ACE2 (0.43) TSHRSMN1; SMN2
SCHEMBL2343809 0.69 TSHR (0.41) TSHRSMN1; SMN2CTSK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110621756-A Curable compositions and low tack self-adhering adhesives prepared therefrom 阿科玛法国公司 2019-12-27 CN disclosed
US-5384380-A Polymerizable compositions and high refractive plastic lens obtained therefrom DAISO CO., LTD. (JP) 1995-01-24 US disclosed
EP-0606905-A2 Polymerizable compositions and high refractive plastic lens obtained therefrom DAISO CO., LTD. (JP) 1994-07-20 EP disclosed