SCHEMBL200412

SCHEMBL200412

CC(C)Sc1cccc(SC(C)C)c1O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 4/20 0.43
GABRB2 P47870 4/20 0.43
CA2 P00918 4/20 0.42
CA1 P00915 3/20 0.42
LMNA P02545 2/20 0.42
HPGD P15428 2/20 0.42
FAAH O00519 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42
TSHR P16473 1/20 0.42
GABRB1 P18505 1/20 0.42
GABRG2 P18507 1/20 0.42
PTGS1 P23219 1/20 0.42
SLC6A2 P23975 1/20 0.42
HTR2C P28335 1/20 0.42
GABRB3 P28472 1/20 0.42
GABRA5 P31644 1/20 0.42
GABRA3 P34903 1/20 0.42
HTR2B P41595 1/20 0.42
GABRA2 P47869 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
SCHEMBL19145105 0.89 HPGD (0.46) GABRA1GABRB2CA2CA1LMNA
SCHEMBL1274943 0.82 CA2 (0.57) GABRA1GABRB2CA2CA1LMNA
SCHEMBL30548758 0.78 MAP2K7 (0.41) LMNAALDH1A1CETPALOX15TDP1
SCHEMBL79176 0.78 GABRA1 (0.44) GABRA1GABRB2CA2CA1LMNA
SCHEMBL1275576 0.78 FFAR1 (0.31) CA2CA1PTGS1
SCHEMBL199564 0.78 GABRA1 (0.42) GABRA1GABRB2CA2CA1LMNA
SCHEMBL200411 0.77 MAP2K7 (0.42) ALDH1A1CETPMAP2K7CDC25ACDC25B
SCHEMBL24121623 0.76 MAP2K7 (0.34) GABRA1GABRB2CA2CA1LMNA
SCHEMBL17307293 0.72 TP53 (0.39) CA2CA1LMNAHPGDCYP3A4
SCHEMBL199801 0.70 GABRA1 (0.42) GABRA1GABRB2CA2CA1LMNA

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 305 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3363824-B1 MULTICOMPONENT COPOLYMER, RUBBER COMPOSITION, CROSS-LINKED RUBBER COMPOSITION, RUBBER PRODUCT, AND TIRE BRIDGESTONE CORP (JP) 2024-05-01 EP disclosed
EP-3954549-B1 POLYISOPRENE, RUBBER COMPOSITION, AND TIRE BRIDGESTONE CORP (JP) 2023-12-13 EP disclosed
CN-113677543-B Polyisoprene, rubber composition and tire 株式会社普利司通 2023-04-28 CN disclosed
EP-3363831-B1 MULTI-COMPONENT COPOLYMER, RUBBER COMPOSITION, CROSSLINKED RUBBER COMPOSITION, RUBBER PRODUCT AND TIRE BRIDGESTONE CORP (JP) 2023-02-01 EP disclosed
EP-3363832-B1 MULTI-COMPONENT COPOLYMER, RUBBER COMPOSITION, CROSSLINKED RUBBER COMPOSITION, RUBBER PRODUCT, AND TIRE BRIDGESTONE CORP (JP) 2023-01-25 EP disclosed
US-11518831-B2 Method for producing multicomponent copolymer, multicomponent copolymer, rubber composition, and tire BRIDGESTONE CORPORATION (JP) 2022-12-06 US disclosed
US-20220220238-A1 METHOD FOR MANUFACTURING COPOLYMER BRIDGESTONE CORPORATION (JP) 2022-07-14 US disclosed
US-20220213240-A1 MULTI-COMPONENT COPOLYMER, RUBBER COMPOSITION, RESIN COMPOSITION, TIRE, AND RESIN PRODUCT BRIDGESTONE CORPORATION (JP) 2022-07-07 US disclosed
CN-110536907-B Method for producing multipolymer, rubber composition and tire 株式会社普利司通 2022-06-17 CN disclosed
US-20220185921-A1 POLYISOPRENE, RUBBER COMPOSITION, AND TIRE BRIDGESTONE CORPORATION (JP) 2022-06-16 US disclosed
EP-1541593-A1 CATALYST COMPOSITION RIKEN (JP) 2005-06-15 EP disclosed
EP-1512700-A1 POLYMERIZATION CATALYST RIKEN (JP) 2005-03-09 EP disclosed
EP-1500667-A1 CATALYST COMPOSITION Riken (JP) 2005-01-26 EP disclosed
US-6683140-B2 Catalyst for polymerization RIKEN (JP) 2004-01-27 US disclosed
US-20030166458-A1 Block copolymerization of a conjugated diene and an aromatic vinyl compound, which comprises the steps of carrying out homopolymerization of the conjugated diene in the presence of a catalyst composition comprising the following RIKEN (JP) 2003-09-04 US disclosed
US-6596828-B1 polymerization of a conjugated diene or copolymerization of a conjugated diene and an aromatic vinyl compound, which comprises the following components: (A) a metallocene-type complex of a rare earth metal compound (samarium complex RIKEN (JP) 2003-07-22 US disclosed
US-20030018144-A1 Catalyst composition RIKEN (JP) 2003-01-23 US disclosed
EP-1270626-A1 CATALYST COMPOSITION AND PROCESS FOR PRODUCING COPOLYMER Riken (JP) 2003-01-02 EP disclosed
US-20020119889-A1 Catalyst for polymerization RIKEN (JP) 2002-08-29 US disclosed
EP-1086957-A1 CATALYST COMPOSITION Riken (JP) 2001-03-28 EP disclosed