SCHEMBL385574

SCHEMBL385574

CCc1cc(C(C)=O)ccc1O

nearest known ligand 0.75

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.75
HSD17B1 P14061 1/20 0.73
POLB P06746 1/20 0.69
HTT P42858 2/20 0.66
HSP90AA1 P07900 1/20 0.62
HSP90AB1 P08238 1/20 0.62
BACE1 P56817 1/20 0.52
ALDH1A1 P00352 3/20 0.51
HPGD P15428 1/20 0.51
ESR1 P03372 3/20 0.50
ESR2 Q92731 3/20 0.50
KMT2A Q03164 3/20 0.50
KDM4E B2RXH2 1/20 0.49
MEN1 O00255 1/20 0.45
JAK2 O60674 1/20 0.44
CREBBP Q92793 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
SCHEMBL9616832 0.86 PKM (0.68) PKMHSD17B1POLBHTTHSP90AA1
SCHEMBL8845203 0.86 PKM (0.72) PKMHSD17B1POLBHTTHSP90AA1
SCHEMBL9574305 0.86 PKM (1.00) PKMHSD17B1POLBHTTHSP90AA1
SCHEMBL9763047 0.85 HSP90AA1 (0.65) PKMHSD17B1POLBHTTHSP90AA1
SCHEMBL4096708 0.85 HSD17B1 (1.00) PKMHSD17B1POLBHTTHSP90AA1
SCHEMBL29291399 0.84 PKM (0.70) PKMHSD17B1POLBHTTHSP90AA1
SCHEMBL469648 0.84 PKM (0.70) PKMHSD17B1POLBHTTHSP90AA1
SCHEMBL10743832 0.84 PKM (0.70) PKMHSD17B1POLBHTTHSP90AA1
SCHEMBL9644638 0.83 PKM (0.64) PKMHSD17B1POLBHTTHSP90AA1
SCHEMBL335280 0.83 POLB (0.97) PKMHSD17B1POLBHTTHSP90AA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115974586-A Colorful heat-preservation soft porcelain and preparation method thereof 颜如玉 2023-04-18 CN claimed
CN-115974586-A Colorful heat-preservation soft porcelain and preparation method thereof 颜如玉 2023-04-18 CN disclosed
CN-115974586-A Colorful heat-preservation soft porcelain and preparation method thereof 颜如玉 2023-04-18 CN disclosed
EP-2330098-B1 COMPOUND WITH AGITATION EFFECT ON PEROXISOME PROLIFERATOR-ACTIVATED RECEPTOR SUBTYPE delta, AND PREPARATION METHOD AND USE THEREOF ZHEJIANG HISUN PHARM CO LTD (CN) 2015-04-29 EP disclosed
US-8822519-B2 Compound with agitation effect on peroxisome proliferator-activated receptor process for its preparation and use thereof ZHEJIANG HISUN PHARMACEUTICAL CO., LTD. (CN) 2014-09-02 US disclosed
CN-102112452-B Compound with agonism on delta subtype peroxidase proliferator activated receptor, preparation method and application thereof ZHEJIANG HISUN PHARMACEUTICAL 2014-05-14 CN disclosed
CN-101643451-B Peroxisome proliferator-activated receptor subtype delta agonist compound and preparation method thereof ZHEJIANG HISUN PHARM CO LTD 2013-03-06 CN disclosed
US-8101625-B2 Pyrimidinones as Casein Kinase II (CK2) modulators EXELIXIS, INC. (US) 2012-01-24 US disclosed
US-20110319458-A1 COMPOUND WITH AGITATION EFFECT ON PEROXISOME PROLIFERATOR-ACTIVATED RECEPTOR. PROCESS FOR ITS PREPARATION AND USE THEREOF ZHEJIANG HISUN PHARMACEUTICAL CO., LTD. (CN) 2011-12-29 US disclosed
EP-1948617-B1 PYRIMIDINONES AS CASEIN KINASE II (CK2) MODULATORS EXELIXIS INC (US) 2011-07-27 EP disclosed
US-20090215803-A1 Pyrimidinones as Casein Kinase II (CK2) Modulators EXELIXIS, INC. 2009-08-27 US disclosed
US-6949536-B2 Sulfonylbenzene compounds as anti-inflammatory/analgesic agents PFIZER, INC. (US) 2005-09-27 US disclosed
US-20040157824-A1 Sulfonylbenzene compounds as anti-inflammatory/analgesic agents PFIZER INC. 2004-08-12 US disclosed
EP-1086097-B1 SULFONYLBENZENE COMPOUNDS AS ANTI-INFLAMMATORY/ANALGESIC AGENTS PFIZER (US) 2004-05-19 EP disclosed
US-6727238-B2 CYCLOOXYGENASE INHIBITORS PFIZER INC. 2004-04-27 US disclosed
US-20030225064-A1 Sulfonylbenzene compounds as anti-inflammatory/analgesic agents ANDO KAZUO (JP) 2003-12-04 US disclosed
US-6608095-B2 Sulfonylbenzene and sulfonamidobenzene compounds which inhibit COX-2; treatment of a medical condition in which prostaglandins are implicated as pathogens PFIZER INC. 2003-08-19 US disclosed
US-20020045654-A1 Sulfonylbenzene compounds as anti-inflammatory/analgesic agents ANDO KAZUO (JP) 2002-04-18 US disclosed
US-6294558-B1 ANTIINFLAMMATORY AGENTS AND PROSTAGLANTINS PFIZER INC. 2001-09-25 US disclosed
US-5113019-A PROCESS FOR PHENOL ALKYLTHIOLATION AND ITS APPLICATION TO THE SYNTHESIS OF 4-ACYL-2-ALKYLTHIOPHENOLS SOCIETE NATIONALE ELF AQUITAINE (PRODUCTION) (FR) 1992-05-12 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 (5 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-20040157824-A1 Sulfonylbenzene compounds as anti-inflammatory/analgesic agents CNR1, PTGS1, PTGER1 PKM 3087/4885HSD17B1 515/4885POLB 4325/4885
US-20020045654-A1 Sulfonylbenzene compounds as anti-inflammatory/analgesic agents CNR1, PTGER1, PTGS1 PKM 3481/4885HSD17B1 532/4885POLB 4345/4885
US-20110319458-A1 COMPOUND WITH AGITATION EFFECT ON PEROXISOME PROLIFERATOR-ACTIVATED RECEPTOR. PROCESS FOR ITS PREPARATION AND USE THEREOF PPARG, PPARD, PPARA PKM 277/4885HSD17B1 294/4885POLB 711/4885
US-20030225064-A1 Sulfonylbenzene compounds as anti-inflammatory/analgesic agents CNR1, PTGS1, PTGER1 PKM 3087/4885HSD17B1 515/4885POLB 4325/4885
US-20090215803-A1 Pyrimidinones as Casein Kinase II (CK2) Modulators CSNK2A1, CSNK1A1, CSNK2A2 PKM 260/4885HSD17B1 3103/4885POLB 1373/4885

“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.