SCHEMBL6284464

SCHEMBL6284464

CCOC(=O)[C@@H](O)Cc1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP8 P22894 2/20 0.59
CYP1A2 P05177 2/20 0.54
CYP2C9 P11712 1/20 0.54
HIF1A Q16665 1/20 0.54
ALDH1A1 P00352 2/20 0.52
TP53 P04637 1/20 0.52
NPY1R P25929 1/20 0.51
NPY2R P49146 1/20 0.51
PIN1 Q13526 1/20 0.50
PKM P14618 1/20 0.49
EPHX2 P34913 1/20 0.49
PPARG P37231 1/20 0.49
MEN1 O00255 1/20 0.49
NPC1 O15118 1/20 0.49
KMT2A Q03164 1/20 0.49
L3MBTL1 Q9Y468 3/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
LMNA P02545 2/20 0.48
POLB P06746 1/20 0.47
HSD17B10 Q99714 1/20 0.47

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
SCHEMBL1245765 1.00 MMP8 (0.59) MMP8CYP1A2CYP2C9HIF1AALDH1A1
SCHEMBL1785293 1.00 MMP8 (0.59) MMP8CYP1A2CYP2C9HIF1AALDH1A1
SCHEMBL5390701 0.93 MMP8 (0.54) MMP8CYP1A2CYP2C9HIF1AALDH1A1
SCHEMBL5375675 0.87 L3MBTL1 (0.65) ALDH1A1PPARGL3MBTL1LMNA
SCHEMBL1596779 0.87 L3MBTL1 (0.65) ALDH1A1PPARGL3MBTL1LMNA
SCHEMBL4756342 0.87 L3MBTL1 (0.65) ALDH1A1PPARGL3MBTL1LMNA
SCHEMBL5810826 0.86 LMNA (0.51) MMP8CYP1A2ALDH1A1PPARGNPC1
SCHEMBL14305548 0.85 NPY1R (0.56) MMP8CYP1A2CYP2C9HIF1AALDH1A1
SCHEMBL5385979 0.84 ESR1 (0.50) MMP8CYP1A2CYP2C9HIF1A
SCHEMBL5100527 0.84 ESR1 (0.50) MMP8CYP1A2CYP2C9HIF1A

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-108137497-B Bicyclic derivatives, process for their preparation and pharmaceutical compositions containing them 法国施维雅药厂 2021-06-15 CN disclosed
WO-2021067827-A1 MCL1 INHIBITORS AND USES THEREOF CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2021-04-08 WO disclosed
US-10449208-B2 Antiviral prodrugs of tenofovir MERCK SHARP & DOHME CORP. (US) 2019-10-22 US disclosed
US-20140031230-A1 AUXIN BIOSYNTHESIS INHIBITOR Riken Public University Corporation Yokohama City University 2014-01-30 US disclosed
US-6911468-B2 Tyrosine phosphatase inhibitors TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2005-06-28 US disclosed
US-20030144338-A1 Tyrosine phosphatase inhibitors TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2003-07-31 US disclosed
EP-1284260-A1 TYROSINE PHOSPHATASE INHIBITORS Takeda Chemical Industries, Ltd. (JP) 2003-02-19 EP disclosed
EP-0417698-B1 Amino acid derivatives having renin-inhibiting activity, process for their preparation, agents containing them, and their use HOECHST AG (DE) 1996-03-13 EP disclosed
US-5374731-A Treatment of high blood pressure, congestive heart failure and viral disorders HOECHST AKTIENGESELLSCHAFT (DE) 1994-12-20 US disclosed
EP-0417698-A2 Amino acid derivatives having renin-inhibiting activity, process for their preparation, agents containing them, and their use HOECHST AKTIENGESELLSCHAFT (DE) 1991-03-20 EP 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 (3 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-20030144338-A1 Tyrosine phosphatase inhibitors PTPRC, PTPN1, PTPRM MMP8 3352/4885CYP1A2 2824/4885CYP2C9 3509/4885
US-10449208-B2 Antiviral prodrugs of tenofovir PNP, TYMP, HPRT1 MMP8 681/4885CYP1A2 800/4885CYP2C9 130/4885
US-20140031230-A1 AUXIN BIOSYNTHESIS INHIBITOR AGXT, AOX1, FDPS MMP8 4444/4885CYP1A2 356/4885CYP2C9 1203/4885

“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.