SCHEMBL1685285

SCHEMBL1685285

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

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 3/20 0.50
GABRG2 P18507 2/20 0.50
GABRB3 P28472 2/20 0.50
LMNA P02545 2/20 0.50
GABRB2 P47870 2/20 0.50
FAAH O00519 1/20 0.50
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
CYP1A2 P05177 1/20 0.50
CYP3A4 P08684 1/20 0.50
HPGD P15428 1/20 0.50
TSHR P16473 1/20 0.50
GABRB1 P18505 1/20 0.50
PTGS1 P23219 1/20 0.50
SLC6A2 P23975 1/20 0.50
HTR2C P28335 1/20 0.50
GABRA5 P31644 1/20 0.50
GABRA3 P34903 1/20 0.50
HTR2B P41595 1/20 0.50
GABRA2 P47869 1/20 0.50

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
SCHEMBL1685298 0.83 CYP3A4 (0.40) GABRA1GABRG2GABRB3LMNAGABRB2
SCHEMBL1685284 0.79 GABRA1 (0.37) GABRA1GABRG2GABRB3LMNAGABRB2
SCHEMBL14825520 0.79 GABRA1 (0.52) GABRA1GABRG2GABRB3LMNAGABRB2
SCHEMBL6637397 0.79 FABP3 (0.59) GABRA1GABRG2GABRB3LMNAGABRB2
SCHEMBL1275261 0.77 GABRA1 (0.50) GABRA1GABRG2GABRB3LMNAGABRB2
SCHEMBL4056882 0.77 GABRA1 (0.48) GABRA1GABRG2GABRB3LMNAGABRB2
SCHEMBL8133970 0.77 SMN1; SMN2 (0.52) GABRA1GABRG2GABRB3LMNAGABRB2
SCHEMBL1459969 0.76 GABRA1 (0.54) GABRA1GABRG2GABRB3LMNAGABRB2
SCHEMBL28406897 0.76 GABRA1 (0.48) GABRA1GABRG2GABRB3LMNAGABRB2
SCHEMBL6864306 0.75 GABRA1 (0.43) GABRA1GABRG2GABRB3LMNAGABRB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6262197-B1 AS POLYMERIZATION CATALYST IN OLEFIN POLYMERIZATION TARGOR GMBH (DE) 2001-07-17 US claimed
US-5808122-A Organometallic compound HOECHST AKTIENGESELLSCHAFT (DE) 1998-09-15 US claimed
US-5726333-A POLYMERIZATION CATALYSTS HOECHST AG (DE) 1998-03-10 US claimed
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-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-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-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-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
US-5776851-A COORDINATION POLYMERIZATION CATALYST TARGOR GMBH (DE) 1998-07-07 US disclosed
US-5726333-A POLYMERIZATION CATALYSTS HOECHST AG (DE) 1998-03-10 US disclosed
US-5693730-A METALLOCENES HAVING MORE THAN ONE CENTRAL ATOM AND A SPECIAL BRIDGE STRUCTURE FOR PREPARING ISOTACTIC, HIGH-MOLECULAR-WEIGHT POLYMERS HAVING GOOD GRAIN MORPHOLOGY; PROPYLENE HOMO- AND COPOLYMERS HOECHST AKTIENGESELLSCHAFT (DE) 1997-12-02 US disclosed
US-5585508-A POLYMERIZATION CATALYST FOR POLYOLEFINS HOECHST AG (DE) 1996-12-17 US disclosed
EP-0742225-A1 Organometallic compound HOECHST AKTIENGESELLSCHAFT (DE) 1996-11-13 EP disclosed
EP-0742046-A2 Organometallic compounds HOECHST AKTIENGESELLSCHAFT (DE) 1996-11-13 EP disclosed
EP-0739897-A1 Polynuclear metallocene compound, process for preparing it and its use as catalyst HOECHST AKTIENGESELLSCHAFT (DE) 1996-10-30 EP disclosed
EP-0694557-A2 Organo metallic compounds HOECHST AKTIENGESELLSCHAFT (DE) 1996-01-31 EP disclosed
EP-0654476-A1 Metallocenes, their preparation and use as catalysts HOECHST AKTIENGESELLSCHAFT (DE) 1995-05-24 EP disclosed