SCHEMBL1685284

SCHEMBL1685284

CC(C)c1cccc(CC(C)(C)C)c1C([NH])=O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 3/20 0.37
GABRG2 P18507 2/20 0.37
GABRB3 P28472 2/20 0.37
SMN1; SMN2 Q16637 1/20 0.36
LMNA P02545 2/20 0.36
GABRB2 P47870 2/20 0.36
FAAH O00519 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
HPGD P15428 1/20 0.36
TSHR P16473 1/20 0.36
GABRB1 P18505 1/20 0.36
PTGS1 P23219 1/20 0.36
SLC6A2 P23975 1/20 0.36
HTR2C P28335 1/20 0.36
GABRA5 P31644 1/20 0.36
GABRA3 P34903 1/20 0.36
HTR2B P41595 1/20 0.36

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
SCHEMBL1685206 0.85 GABRA1 (0.40) GABRA1GABRB2HPGDTSHRHIF1A
SCHEMBL1275864 0.84 GABRA1 (0.37) GABRA1GABRG2GABRB3SMN1; SMN2LMNA
SCHEMBL1685285 0.79 GABRA1 (0.50) GABRA1GABRG2GABRB3SMN1; SMN2LMNA
SCHEMBL1685282 0.78 CA2 (0.38) GABRA1GABRB2CA2TSHRPTGS1
SCHEMBL28412723 0.76 KMT2A (0.49) SMN1; SMN2LMNACYP1A2CYP3A4HPGD
SCHEMBL1685298 0.76 CYP3A4 (0.40) GABRA1GABRG2GABRB3SMN1; SMN2LMNA
SCHEMBL1274738 0.75 GABRA1 (0.57) GABRA1GABRG2GABRB3SMN1; SMN2LMNA
SCHEMBL1274737 0.75 GABRA1 (0.38) GABRA1GABRG2GABRB3SMN1; SMN2LMNA
SCHEMBL6682046 0.74 RIPK1 (0.44) GABRA1GABRG2GABRB3LMNAGABRB2
SCHEMBL1275866 0.71 GABRA1 (0.38) GABRA1GABRG2GABRB3SMN1; SMN2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110536907-B Method for producing multipolymer, rubber composition and tire 株式会社普利司通 2022-06-17 CN disclosed
CN-110520449-B Method for producing multipolymer, rubber composition and tire 株式会社普利司通 2021-09-21 CN disclosed
CN-108137759-B Multipolymer, rubber composition, crosslinked rubber composition and rubber product 株式会社普利司通 2021-03-09 CN disclosed
CN-108350129-B Multipolymer, rubber composition, crosslinked rubber composition and rubber product 株式会社普利司通 2021-03-09 CN disclosed
CN-108137745-B Multipolymer, rubber composition, crosslinked rubber composition and rubber product 株式会社普利司通 2021-03-09 CN disclosed
CN-109071685-B Terminal-modified conjugated diene polymer, rubber composition, and rubber article 株式会社普利司通 2020-12-01 CN disclosed
CN-108137758-B Multipolymer, rubber composition, crosslinked rubber composition and rubber product 株式会社普利司通 2020-10-23 CN disclosed
CN-108137765-B Multipolymer, rubber composition, crosslinked rubber composition and rubber product 株式会社普利司通 2020-09-18 CN disclosed
CN-108137766-B Multipolymer, rubber composition, crosslinked rubber composition and rubber product 株式会社普利司通 2020-09-04 CN disclosed
CN-108290972-B Polymerization catalyst composition and method for producing conjugated diene polymer 株式会社普利司通 2020-06-26 CN disclosed
US-20050170951-A1 Catalyst composition RIKEN (JP) 2005-08-04 US disclosed
EP-1541593-A1 CATALYST COMPOSITION RIKEN (JP) 2005-06-15 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