SCHEMBL809486

SCHEMBL809486

CCCCCC[B-](CCCCCC)(CCCCCC)CCCCCC

nearest known ligand 0.57

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.57
THRB P10828 1/20 0.57
DNM1 Q05193 7/20 0.42
ALDH1A1 P00352 3/20 0.42
LMNA P02545 2/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
HSD17B10 Q99714 1/20 0.42
SLC22A1 O15245 1/20 0.42
EPHX1 P07099 1/20 0.42

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
SCHEMBL5716311 1.00 TSHR (0.57) TSHRTHRBDNM1ALDH1A1LMNA
SCHEMBL10799739 1.00 TSHR (0.57) TSHRTHRBDNM1ALDH1A1LMNA
SCHEMBL5715695 1.00 TSHR (0.57) TSHRTHRBDNM1ALDH1A1LMNA
SCHEMBL12471376 0.97 TSHR (0.53) TSHRTHRBDNM1ALDH1A1LMNA
SCHEMBL2875141 0.96 TSHR (0.50) TSHRTHRBDNM1ALDH1A1LMNA
SCHEMBL7751336 0.93 TSHR (0.47) TSHRTHRBDNM1ALDH1A1LMNA
Fluoride SCHEMBL19810586 0.93 TSHR (0.47) TSHRTHRBDNM1ALDH1A1LMNA
Potassium Ion SCHEMBL5672140 0.93 TSHR (0.47) TSHRTHRBDNM1ALDH1A1LMNA
SCHEMBL15799696 0.93 TSHR (0.47) TSHRTHRBDNM1ALDH1A1LMNA
SCHEMBL5489526 0.93 TSHR (0.47) TSHRTHRBDNM1ALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4043502-B1 PHOTOPOLYMERIZABLE HOE COMPOSITION XETOS AG (DE) 2023-10-04 EP claimed
EP-4043961-B1 2K SYSTEM XETOS AG (DE) 2023-08-16 EP claimed
EP-4043963-B1 IMPROVED BLEACHING XETOS AG (DE) 2023-07-05 EP claimed
EP-2218745-B1 Prepolymer-based polyurethane formulations for producing holographic films BAYER MATERIALSCIENCE AG (DE) 2011-11-23 EP claimed
EP-1661900-A1 Olefin polymerization cocatalysts derived from group-15 cationic compounds and processes using them ExxonMobil Chemical Patents Inc. (US) 2006-05-31 EP disclosed