SCHEMBL18113099

SCHEMBL18113099

CCOC(=O)c1ccccc1SC(=O)CC

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 6/20 0.62
▸ ALDH1A1 P00352 7/20 0.54
▸ HSD17B10 Q99714 3/20 0.54
▸ LMNA P02545 3/20 0.51
▸ NPSR1 Q6W5P4 2/20 0.51
▸ L3MBTL1 Q9Y468 2/20 0.47
▸ TDP1 Q9NUW8 1/20 0.47
▸ CDC25B P30305 2/20 0.47
▸ CYP3A4 P08684 3/20 0.46
▸ MAPK1 P28482 2/20 0.46
▸ TP53 P04637 1/20 0.46
▸ KDM4E B2RXH2 3/20 0.44
▸ CYP1A2 P05177 3/20 0.44
▸ CYP2C19 P33261 3/20 0.44
▸ KMT2A Q03164 2/20 0.43
▸ MAPT P10636 2/20 0.43
▸ CYP2C9 P11712 2/20 0.43
▸ CDC25A P30304 1/20 0.43
▸ CDC25C P30307 1/20 0.43
▸ MEN1 O00255 1/20 0.43

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
SCHEMBL18113159 0.85 TSHR (0.65) TSHRALDH1A1HSD17B10LMNANPSR1
SCHEMBL18113304 0.85 TSHR (0.56) TSHRALDH1A1HSD17B10LMNANPSR1
SCHEMBL18113301 0.84 TSHR (0.62) TSHRALDH1A1HSD17B10LMNANPSR1
SCHEMBL11633418 0.83 TSHR (0.71) TSHRALDH1A1HSD17B10LMNANPSR1
SCHEMBL944028 0.83 TSHR (0.71) TSHRALDH1A1HSD17B10LMNANPSR1
SCHEMBL19895790 0.83 TSHR (0.61) TSHRALDH1A1HSD17B10LMNANPSR1
SCHEMBL18113235 0.83 TSHR (0.61) TSHRALDH1A1HSD17B10LMNANPSR1
SCHEMBL3815073 0.82 CHRM2 (0.63) TSHRALDH1A1LMNANPSR1L3MBTL1
SCHEMBL1959525 0.81 TSHR (0.69) TSHRALDH1A1HSD17B10LMNANPSR1
SCHEMBL7754646 0.81 TSHR (0.69) TSHRALDH1A1HSD17B10LMNANPSR1

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-3277736-B1 CATALYST COMPONENTS FOR THE POLYMERIZATION OF OLEFINS BASELL POLIOLEFINE ITALIA SRL (IT) 2019-03-27 — — EP disclosed
US-10011668-B2 Catalyst components for the polymerization of olefins BASELL POLIOLEFINE ITALIA S.R.L. (IT) 2018-07-03 — — US disclosed
US-20180057622-A1 CATALYST COMPONENTS FOR THE POLYMERIZATION OF OLEFINS BASELL POLIOLEFINE ITALIA S.R.L. (IT) 2018-03-01 — — US disclosed
EP-3277736-A1 CATALYST COMPONENTS FOR THE POLYMERIZATION OF OLEFINS Basell Poliolefine Italia S.r.l. (IT) 2018-02-07 — — EP disclosed
WO-2016156473-A1 CATALYST COMPONENTS FOR THE POLYMERIZATION OF OLEFINS BASELL POLIOLEFINE ITALIA S.R.L. (IT) 2016-10-06 — — WO disclosed
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