SCHEMBL7106569

SCHEMBL7106569

CC(C)(C)Sc1cc(Cl)cc(SC(C)(C)C)c1

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.35
SLC2A1 P11166 1/20 0.34
KDM4E B2RXH2 1/20 0.33
HSD17B10 Q99714 1/20 0.33
HPN P05981 1/20 0.33
MAPT P10636 1/20 0.33
ALOX15 P16050 1/20 0.33
SIRT5 Q9NXA8 1/20 0.33
AR P10275 1/20 0.32
SLC6A4 P31645 1/20 0.32

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
SCHEMBL5852969 0.95 TSHR (0.42) TSHRSLC2A1KDM4EHSD17B10HPN
SCHEMBL7105716 0.86 HPN (0.40) SLC2A1KDM4EHSD17B10HPNMAPT
SCHEMBL23375759 0.78 TPMT (0.55) TSHRSLC2A1HSD17B10ALOX15
SCHEMBL23976617 0.78 TPMT (0.36) SLC2A1MAPT
SCHEMBL25362159 0.77 AR (0.33) AR
SCHEMBL7109277 0.77 POLB (0.41) TSHRKDM4EARSLC6A4
SCHEMBL11661820 0.74 ALOX15 (0.43) TSHRSLC2A1KDM4EHSD17B10HPN
SCHEMBL2737144 0.74 SLC6A4 (0.45) TSHRKDM4EHSD17B10MAPTAR
SCHEMBL12286151 0.70 ALDH1A1 (0.36) TSHRSLC2A1KDM4EHSD17B10HPN
SCHEMBL31351861 0.70 SLC6A4 (0.42) KDM4EHSD17B10HPNMAPTALOX15

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-1044965-B1 PROCESS FOR THE PREPARATION OF AROMATIC SULFUR COMPOUNDS NIPPON FINECHEMICAL CO LTD (JP) 2003-10-01 EP disclosed
US-6376716-B1 REACTING AN AROMATIC THIOETHER WITH LEWIS ACIDS; FORMING AROMATIC MERCAPTAN NIPPON FINECHEMICAL CO., LTD. (JP) 2002-04-23 US disclosed
EP-1044965-A1 PROCESS FOR THE PREPARATION OF AROMATIC SULFUR COMPOUNDS Nippon Finechemical Co., Ltd. (JP) 2000-10-18 EP disclosed