SCHEMBL647950

SCHEMBL647950

CC(C)c1cc(S)cc(C(C)C)c1O

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.64
CA2 P00918 2/20 0.64
GABRA1 P14867 6/20 0.58
GABRB1 P18505 5/20 0.58
GABRB2 P47870 3/20 0.58
CYP1A2 P05177 3/20 0.50
CYP3A4 P08684 3/20 0.50
FAAH O00519 1/20 0.50
LMNA P02545 1/20 0.50
HPGD P15428 1/20 0.50
TSHR P16473 1/20 0.50
GABRG2 P18507 1/20 0.50
PTGS1 P23219 1/20 0.50
SLC6A2 P23975 1/20 0.50
HTR2C P28335 1/20 0.50
GABRB3 P28472 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
SCHEMBL21767287 0.88 GABRA1 (0.59) CA1CA2GABRA1GABRB1GABRB2
SCHEMBL31196986 0.81 CA2 (0.43) CA1CA2GABRA1GABRB1GABRB2
SCHEMBL275427 0.78 CA1 (1.00) CA1CA2GABRA1GABRB1GABRB2
SCHEMBL1760529 0.78 CA1 (0.70) CA1CA2GABRA1GABRB1GABRB2
SCHEMBL94533 0.76 GABRA1 (0.77) CA1CA2GABRA1GABRB1GABRB2
SCHEMBL544651 0.76 CA1 (0.67) CA1CA2GABRA1GABRB1GABRB2
SCHEMBL9199239 0.74 CA1 (0.41) CA1CA2GABRA1GABRB1GABRB2
SCHEMBL3640323 0.74 GABRA1 (1.00) CA1CA2GABRA1GABRB1GABRB2
SCHEMBL1163939 0.74 GABRA1 (1.00) CA1CA2GABRA1GABRB1GABRB2
SCHEMBL6868812 0.74 CA1 (0.64) CA1CA2GABRA1GABRB1GABRB2

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119708052-A Compound for polyolefin antioxidation and preparation and application thereof 中国石油天然气股份有限公司 2025-03-28 CN disclosed
CN-119143644-A Intramolecular composite antioxidant and poly 4-methyl-1-pentene material 中国石油天然气股份有限公司 2024-12-17 CN disclosed
CN-119143641-A Preparation method of intramolecular composite antioxidant 中国石油天然气股份有限公司 2024-12-17 CN disclosed
EP-2070919-B1 SPIROQUINONE COMPOUND AND PHARMACEUTICAL COMPOSITION HYKES LAB LLC (JP) 2012-10-10 EP disclosed
US-8119686-B2 Spiroquinone compound and pharmaceutical composition HYKES LABORATORIES LLC (JP) 2012-02-21 US disclosed
US-20100056613-A1 SPIROQUINONE COMPOUND AND PHARMACEUTICAL COMPOSITION HYKES LABORATORIES LLC (JP) 2010-03-04 US disclosed
EP-2070919-A1 SPIROQUINONE COMPOUND AND PHARMACEUTICAL COMPOSITION Hykes Laboratories LLC (JP) 2009-06-17 EP disclosed
US-7314693-B2 Electrophotographic photoconductor, electrophotographic process, electrophotographic apparatus, and process cartridge RICOH COMPANY, LTD. (JP) 2008-01-01 US disclosed
US-7314693-B2 Electrophotographic photoconductor, electrophotographic process, electrophotographic apparatus, and process cartridge RICOH COMPANY, LTD. (JP) 2008-01-01 US disclosed
US-4740578-A CATALYTIC REACTION OF MONOCHLORIDE WITH A PHENOL SEITETSU KAGAKU CO., LTD (JP) 1988-04-26 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100056613-A1 SPIROQUINONE COMPOUND AND PHARMACEUTICAL COMPOSITION NR1H2, NR1H3, APOB CA1 4663/4885CA2 3694/4885GABRA1 3067/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.