SCHEMBL7519005

SCHEMBL7519005

COc1cccc2cc(C(C)=O)c(=O)oc12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.79
CA1 P00915 1/20 0.79
CA2 P00918 1/20 0.79
CA3 P07451 1/20 0.79
CA4 P22748 1/20 0.79
CA6 P23280 1/20 0.79
CA5A P35218 1/20 0.79
CA7 P43166 1/20 0.79
CA9 Q16790 1/20 0.79
CA14 Q9ULX7 1/20 0.79
CA5B Q9Y2D0 1/20 0.79
HSD17B10 Q99714 2/20 0.73
MAOA P21397 1/20 0.68
MAOB P27338 1/20 0.68
POLB P06746 3/20 0.68
ALDH1A1 P00352 5/20 0.68
MAPT P10636 4/20 0.68
LMNA P02545 2/20 0.67
RECQL P46063 1/20 0.67
KMT2A Q03164 3/20 0.64

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
SCHEMBL980310 0.88 CA12 (1.00) CA12CA1CA2CA3CA4
SCHEMBL11495843 0.87 CA12 (0.77) CA12CA1CA2CA3CA4
Hydrochloric Acid SCHEMBL11339314 0.87 CA12 (0.97) CA12CA1CA2CA3CA4
SCHEMBL28445182 0.87 CA12 (0.77) CA12CA1CA2CA3CA4
SCHEMBL11339310 0.87 CA12 (0.77) CA12CA1CA2CA3CA4
SCHEMBL2300842 0.84 HSD17B10 (0.67) CA12CA1CA2CA3CA4
SCHEMBL2034208 0.83 CA12 (0.76) CA12CA1CA2CA3CA4
SCHEMBL31619161 0.83 CA12 (0.71) CA12CA1CA2CA3CA4
SCHEMBL981812 0.83 MAPT (0.78) CA12CA1CA2CA3CA4
SCHEMBL28708408 0.83 CA12 (0.67) CA12CA1CA2CA3CA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115340532-B Wide-band optical absorption molecular material and application thereof 广东省科学院测试分析研究所(中国广州分析测试中心) 2024-04-23 CN disclosed
CN-115340532-A Broadband optical absorption molecular material and application thereof 广东省科学院测试分析研究所(中国广州分析测试中心) 2022-11-15 CN disclosed
CN-105524034-B Preparation, pharmacological action and the application for treating cerebral ischemia of coumarin derivative 北京大学 2018-08-17 CN disclosed
CN-105566269-B Preparation, pharmacological action and the application for treating itch of coumarin derivative 北京大学 2018-07-10 CN disclosed
CN-105566269-A Preparation and pharmacological effects of coumarin derivative and application of coumarin derivative to treatment on pruritus UNIV BEIJING 2016-05-11 CN disclosed
CN-105524034-A Preparation method of coumarin derivative, pharmacological effect of coumarin derivative and use of coumarin derivative in treatment on cerebral ischemia UNIV BEIJING 2016-04-27 CN disclosed
US-7939554-B2 Of Src homology protein tyrosine phosphatase 1; phenyl isothiazolones or a benzo-1,4-quinone; antineoplastic agents; immunostimulants inducing a cytokine response; side effect reduction THE CLEVELAND CLINIC FOUNDATION (US) 2011-05-10 US disclosed
US-20080103160-A1 Protein phosphatase inhibitors THE CLEVELAND CLINIC FOUNDATION 2008-05-01 US disclosed
US-20080051464-A1 Protein phosphatase inhibitors THE CLEVELAND CLINIC FOUNDATION 2008-02-28 US disclosed
EP-0889361-B1 Initiators for cationic polymerization SIEMENS AG (DE) 2002-01-23 EP disclosed
US-6162881-A Initiators for cationic polymerization SIEMENS AKTIEGESELLSCHAFT (DE) 2000-12-19 US disclosed
EP-0889361-A1 Initiators for cationic polymerization SIEMENS AKTIENGESELLSCHAFT (DE) 1999-01-07 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 (2 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-20080103160-A1 Protein phosphatase inhibitors PPM1A, DUSP15, PPM1B CA12 4744/4885CA1 3794/4885CA2 2926/4885
US-20080051464-A1 Protein phosphatase inhibitors PPM1A, DUSP15, PPM1B CA12 4744/4885CA1 3794/4885CA2 2926/4885

“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.