SCHEMBL9116091

SCHEMBL9116091

C[C]CCCCCCCCC

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.53
THRB P10828 1/20 0.53
PTPN7 P35236 3/20 0.41
HMGCR P04035 1/20 0.41
DNM1 Q05193 5/20 0.40
ALDH1A1 P00352 2/20 0.40
LMNA P02545 2/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
HSD17B10 Q99714 1/20 0.40
SLC22A1 O15245 1/20 0.40

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
SCHEMBL1694524 1.00
SCHEMBL1695033 1.00
SCHEMBL1694520 1.00 TSHR (0.53) TSHRTHRBPTPN7HMGCRDNM1
SCHEMBL9116108 1.00 TSHR (0.53) TSHRTHRBPTPN7HMGCRDNM1
SCHEMBL4871727 1.00 TSHR (0.53) TSHRTHRBPTPN7HMGCRDNM1
SCHEMBL1694238 0.97
SCHEMBL443292 0.86
Bicarbonate SCHEMBL9238736 0.83 PTPN7 (0.50) TSHRPTPN7HMGCRALDH1A1MEN1
SCHEMBL23040316 0.76 PTPN7 (0.61) TSHRTHRBPTPN7HMGCRALDH1A1
SCHEMBL6745588 0.76 TSHR (0.57) TSHRTHRBPTPN7HMGCRDNM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2772505-B1 PHOTOCURABLE RESIN COMPOSITION AND NOVEL SILOXANE COMPOUND ADEKA CORP (JP) 2017-11-15 EP disclosed
US-9063415-B2 Photocurable resin composition and novel siloxane compound ADEKA CORPORATION (JP) 2015-06-23 US disclosed
EP-2582740-B1 USE OF CYCLIC CARBONATES IN EPOXY RESIN COMPOSITIONS BASF SE (DE) 2015-03-25 EP disclosed
EP-2772505-A1 PHOTOCURABLE RESIN COMPOSITION AND NOVEL SILOXANE COMPOUND Adeka Corporation (JP) 2014-09-03 EP disclosed
US-20140205949-A1 PHOTOCURABLE RESIN COMPOSITION AND NOVEL SILOXANE COMPOUND ADEKA CORPORATION (JP) 2014-07-24 US disclosed
US-8741988-B2 Use of cyclic carbonates in epoxy resin compositions BASF SE (DE) 2014-06-03 US disclosed
EP-0670834-A1 ALKYLIDENE GLYCEROL SURFACTANTS AND DETERGENT COMPOSITIONS CONTAINING THEM. UNILEVER PLC (GB) 1995-09-13 EP disclosed
WO-1994012489-A1 ALKYLIDENE GLYCEROL SURFACTANTS AND DETERGENT COMPOSITIONS CONTAINING THEM UNILEVER PLC (GB) 1994-06-09 WO disclosed