SCHEMBL1247008

SCHEMBL1247008

CCc1cccc(CCO)c1

nearest known ligand 0.55

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 5/20 0.55
CYP4A11 Q02928 5/20 0.55
TDP1 Q9NUW8 1/20 0.52
KDM4E B2RXH2 1/20 0.45
ALDH1A1 P00352 1/20 0.45
ALOX5 P09917 1/20 0.45
GAA P10253 1/20 0.45
MAPT P10636 1/20 0.45
BACE1 P56817 1/20 0.45
TP53 P04637 1/20 0.44
BCL2 P10415 1/20 0.42
TRPA1 O75762 1/20 0.41
ACMSD Q8TDX5 1/20 0.41
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
MGLL Q99685 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2A6 P11509 1/20 0.40

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
SCHEMBL239199 0.88 TDP1 (0.65) CYP4F2CYP4A11TDP1KDM4EALDH1A1
SCHEMBL80185 0.87 CYP4A11 (0.58) CYP4F2CYP4A11TP53BCL2
SCHEMBL3812842 0.86 TDP1 (0.52) CYP4F2CYP4A11TDP1KDM4EALDH1A1
SCHEMBL9490025 0.85 TP53 (0.52) TP53BCL2TRPA1MEN1KMT2A
SCHEMBL9111608 0.85 CYP4F2 (0.58) CYP4F2CYP4A11
SCHEMBL13703310 0.84 CYP4F2 (0.57) CYP4F2CYP4A11
Hydrogen Peroxide SCHEMBL11520377 0.83 TP53 (0.63) MAPTTP53BCL2TRPA1MGLL
Methyl Alcohol SCHEMBL28745884 0.83 TP53 (0.55) ALDH1A1MAPTTP53BCL2TRPA1
SCHEMBL26240023 0.83 LPL (0.53) CYP4F2CYP4A11TDP1
SCHEMBL166894 0.83 TP53 (0.61) ALDH1A1MAPTTP53BCL2TRPA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230019032-A1 BENZOLACTAM COMPOUNDS AS PROTEIN KINASE INHIBITORS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2023-01-19 US disclosed
EP-3906969-A1 ANTIHYPERTENSIVE POLYOL COMPOUND AND DERIVATIVE THEREOF East China University of Science and Technology (CN) 2021-11-10 EP disclosed
US-11001575-B1 Benzolactam compounds as protein kinase inhibitors OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2021-05-11 US disclosed
US-20150361095-A1 PHOSPHATIDYLINOSITOL 3-KINASE INHIBITORS GILEAD SCIENCES, INC. 2015-12-17 US disclosed
US-8629271-B2 Compounds ASTRAZENECA AB (GB) 2014-01-14 US disclosed
US-8530520-B2 Cycloalkyl-dione derivatives and methods of their use THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2013-09-10 US disclosed
US-20120329877-A1 Cycloalkyl-dione Derivatives And Methods Of Their Use THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2012-12-27 US disclosed
US-20120322788-A1 Compouds PULMAGEN THERAPEUTICS (SYNERGY) LIMITED (GB) 2012-12-20 US disclosed
EP-2459572-A2 SPIROCYCLIC AMIDE DERIVATIVES AstraZeneca AB (SE) 2012-06-06 EP disclosed
US-8148373-B2 Compounds ASTRAZENECA AB (SE) 2012-04-03 US disclosed
WO-2011012896-A2 COMPOUNDS - 801 ASTRAZENECA AB (SE) 2011-02-03 WO disclosed
US-7803956-B2 Benzofuran derivatives useful for treating hyper-proliferative disorders BAYER PHARMACEUTICALS CORPORATION (US) 2010-09-28 US disclosed
US-7754728-B2 Adenine compound and use thereof DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2010-07-13 US disclosed
US-7659412-B2 Benzofuran derivatives useful for treating hyper-proliferative disorders BAYER HEALTHCARE LLC (US) 2010-02-09 US disclosed
US-20090298807-A1 Compounds ASTRAZENECA AB (SE) 2009-12-03 US disclosed
US-20090292014-A1 BENZOFURAN DERIVATIVES USEFUL FOR TREATING HYPER-PROLIFERATIVE DISORDERS ZHANG CHENGZHI 2009-11-26 US disclosed
US-20090023783-A1 BENZOFURAN DERIVATIVES USEFUL FOR TREATING HYPER-PROLIFERATIVE DISORDERS ZHANG CHENGZHI 2009-01-22 US disclosed
US-7420066-B2 Benzofuran derivatives useful for treating hyper-proliferative disorders BAYER PHARMACEUTICALS CORPORATION (US) 2008-09-02 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 (8 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-20090292014-A1 BENZOFURAN DERIVATIVES USEFUL FOR TREATING HYPER-PROLIFERATIVE DISORDERS PCNA, MKI67, CDK4 CYP4F2 1184/4885CYP4A11 1518/4885TDP1 1100/4885
US-20120329877-A1 Cycloalkyl-dione Derivatives And Methods Of Their Use CYP11B2, CYP1B1, SQLE CYP4F2 250/4885CYP4A11 105/4885TDP1 1529/4885
US-20230019032-A1 BENZOLACTAM COMPOUNDS AS PROTEIN KINASE INHIBITORS MAPK1, ALK, MAP3K1 CYP4F2 2482/4885CYP4A11 1183/4885TDP1 884/4885
US-20150361095-A1 PHOSPHATIDYLINOSITOL 3-KINASE INHIBITORS PIK3CA, AKT3, PIK3CD CYP4F2 1980/4885CYP4A11 857/4885TDP1 1294/4885
US-20090023783-A1 BENZOFURAN DERIVATIVES USEFUL FOR TREATING HYPER-PROLIFERATIVE DISORDERS PCNA, MKI67, CDK4 CYP4F2 1184/4885CYP4A11 1518/4885TDP1 1100/4885
US-11001575-B1 Benzolactam compounds as protein kinase inhibitors MAPK1, ALK, MAP3K1 CYP4F2 2605/4885CYP4A11 1204/4885TDP1 931/4885
US-20120322788-A1 Compouds PKD1, SBDS, ABCB11 CYP4F2 62/4885CYP4A11 39/4885TDP1 4262/4885
US-20090298807-A1 Compounds PKD1, SLC10A1, ABCB11 CYP4F2 69/4885CYP4A11 37/4885TDP1 4473/4885

“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.