SCHEMBL3787683

SCHEMBL3787683

CCCCCCCCCCCCCC[S+](CCCCCCCCCCCC)CCCCCCCCCCCC

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
SCHEMBL3199493 1.00 TSHR (0.57) TSHRTHRBDNM1ALDH1A1LMNA
SCHEMBL1171556 1.00 TSHR (0.57) TSHRTHRBDNM1ALDH1A1LMNA
SCHEMBL3791346 1.00 TSHR (0.57) TSHRTHRBDNM1ALDH1A1LMNA
Hydrochloric Acid SCHEMBL11672035 0.97 TSHR (0.53) TSHRTHRBDNM1ALDH1A1LMNA
Hydrochloric Acid SCHEMBL11671892 0.97 TSHR (0.53) TSHRTHRBDNM1ALDH1A1LMNA
Hydrochloric Acid SCHEMBL11619467 0.97 TSHR (0.53) TSHRTHRBDNM1ALDH1A1LMNA
Hydrochloric Acid SCHEMBL11672430 0.97 TSHR (0.53) TSHRTHRBDNM1ALDH1A1LMNA
Bromide SCHEMBL636748 0.97 TSHR (0.53) TSHRTHRBDNM1ALDH1A1LMNA
SCHEMBL4235540 0.97 TSHR (0.53) TSHRTHRBDNM1ALDH1A1LMNA
SCHEMBL11765586 0.97 TSHR (0.53) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1420049-B1 SURFACE-TREATED INORGANIC PARTICLES KANEKA CORP (JP) 2010-04-21 EP disclosed
US-20040197561-A1 Process for producing surface-treated inorganic particle and surface-treated inogranic particle KANEKA CORPORATION (JP) 2004-10-07 US disclosed
EP-1420049-A1 PROCESS FOR PRODUCING SURFACE−TREATED INORGANIC PARTICLE AND SURFACE−TREATED INORGANIC PARTICLE KANEKA CORPORATION (JP) 2004-05-19 EP disclosed