SCHEMBL6208993

SCHEMBL6208993

CC(=O)Sc1ccc(O)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 1/20 0.48
CA2 P00918 7/20 0.43
CA1 P00915 6/20 0.43
CA12 O43570 5/20 0.43
CA9 Q16790 5/20 0.43
ALDH1A1 P00352 4/20 0.43
MAPT P10636 4/20 0.43
CA14 Q9ULX7 4/20 0.43
CA4 P22748 4/20 0.43
CA7 P43166 4/20 0.43
CA3 P07451 3/20 0.43
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
CYP3A4 P08684 2/20 0.43
HSD17B1 P14061 1/20 0.43
BRD4 O60885 1/20 0.43
NR1I2 O75469 1/20 0.43
MB P02144 1/20 0.43
CYP1A1 P04798 1/20 0.43
RARG P13631 1/20 0.43

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
SCHEMBL14341653 0.89 HPGD (0.46) CA2CA1CA12CA9ALDH1A1
SCHEMBL14367054 0.82 L3MBTL1 (0.41) CA2CA1CA12CA9ALDH1A1
SCHEMBL7518002 0.80 MAPT (0.50) ALDH1A1MAPTKMT2ALMNAHPGD
SCHEMBL1157660 0.78 MAPT (0.55) CA2CA1ALDH1A1MAPTBRD4
SCHEMBL9799523 0.78 MAPT (0.55) CA2CA1ALDH1A1MAPTBRD4
SCHEMBL4232728 0.78 TPMT (0.41) CA2CA1CA12CA9ALDH1A1
SCHEMBL15694511 0.78 CES2 (0.42) CA2CA1ALDH1A1MAPTMEN1
SCHEMBL28066049 0.78 TSHR (0.46) CA2CA1CA12CA9ALDH1A1
SCHEMBL6038269 0.78 HPGD (0.38) CA2CA1CA12CA9ALDH1A1
SCHEMBL27311837 0.78 HPGD (0.67) ALDH1A1MAPTKMT2AHSD17B1LMNA

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
EP-0302321-A2 Process for the preparation of thiophenols, and these thiophenols BAYER AG (DE) 1989-02-08 EP claimed
CN-101302177-B Phenolic compound and recording material containing the same NIPPON SODA CO 2013-01-23 CN disclosed
CN-100451001-C Phenolic compound and recording material using the same NIPPON SODA CO (JP) 2009-01-14 CN disclosed
CN-101302177-A Phenolic compound and recording material containing the same NIPPON SODA CO (JP) 2008-11-12 CN disclosed
US-20050256176-A1 Sulphonamide derivatives and their use as tace inhibitors ASTAZENECA AB (SE) 2005-11-17 US disclosed
CN-1639116-A Phenolic compound and recording material using the same NIPPON SODA CO (JP) 2005-07-13 CN disclosed
EP-1539740-A1 SULPHONAMIDE DERIVATIVES AND THEIR USE AS TACE INHIBITORS AstraZeneca AB (SE) 2005-06-15 EP disclosed
WO-2004024715-A1 SULPHONAMIDE DERIVATIVES AND THEIR USE AS TACE INHIBITORS ASTRAZENECA AB (SE) 2004-03-25 WO disclosed
EP-0302321-A2 Process for the preparation of thiophenols, and these thiophenols BAYER AG (DE) 1989-02-08 EP disclosed
US-4025399-A ELECTRICAL, RECORDING LAYER WITH A CONDUCTIVE AGENT, A LEUCO BASE AND A PHENOLIC RESIN CANON KABUSHIKI KAISHA (JA) 1977-05-24 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-20050256176-A1 Sulphonamide derivatives and their use as tace inhibitors ADAM10, ADAM17, TNF NR1H2 1272/4885CA2 1011/4885CA1 114/4885

“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.