SCHEMBL2163029

SCHEMBL2163029

COC(=O)c1ccc(C(N)=O)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA1 P00915 5/20 0.64
▸ CA2 P00918 5/20 0.64
▸ CA12 O43570 3/20 0.64
▸ CA9 Q16790 3/20 0.64
▸ CA14 Q9ULX7 3/20 0.64
▸ CA7 P43166 2/20 0.64
▸ TDP1 Q9NUW8 1/20 0.64
▸ MAPT P10636 4/20 0.63
▸ PARP10 Q53GL7 4/20 0.61
▸ PARP4 Q9UKK3 2/20 0.61
▸ PARP1 P09874 1/20 0.61
▸ PARP2 Q9UGN5 1/20 0.61
▸ LOXL2 Q9Y4K0 1/20 0.61
▸ TSHR P16473 1/20 0.60
▸ ALDH1A1 P00352 3/20 0.57
▸ STS P08842 1/20 0.55
▸ SIRT2 Q8IXJ6 1/20 0.54
▸ KMT2A Q03164 2/20 0.54
▸ PARP15 Q460N3 1/20 0.54
▸ PARP14 Q460N5 1/20 0.54

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
Urea SCHEMBL20838278 0.90 CA1 (0.70) CA1CA2CA12CA9CA14
Methyl Benzoate SCHEMBL28244293 0.89 TSHR (0.79) CA1CA2CA12CA9CA14
SCHEMBL28993944 0.87 CA1 (0.80) CA1CA2CA12CA9CA14
SCHEMBL23600 0.87 CA1 (0.80) CA1CA2CA12CA9CA14
SCHEMBL28704033 0.85 CA1 (0.76) CA1CA2CA12CA9CA14
Water SCHEMBL22720573 0.85 CA1 (0.76) CA1CA2CA12CA9CA14
Ammonia Solution, Strong SCHEMBL28873355 0.85 CA1 (0.76) CA1CA2CA12CA9CA14
SCHEMBL28993277 0.85 CA1 (0.76) CA1CA2CA12CA9CA14
SCHEMBL28531063 0.85 CA1 (0.76) CA1CA2CA12CA9CA14
Methyl Alcohol SCHEMBL28561085 0.85 CA1 (0.76) CA1CA2CA12CA9CA14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117304034-A Photoluminescent color-changing material, and preparation method and application thereof 上海交通大学 2023-12-29 — — CN claimed
CN-112920078-A Method for preparing 4-cyanobenzoic acid methyl ester and method for preparing 4-cyanobenzoic acid 武汉珈汇精化科技有限公司 2021-06-08 — — CN claimed
US-9198426-B2 Use of 5 pyridin-4-yl-1,3-thiazoles for controlling phytopathogenic fungi BAYER INTELLECTUAL PROPERTY GMBH (DE) 2015-12-01 — — US claimed
EP-2378880-A1 USE OF 5-PYRIDIN-4YL(1,3)THIAZOLE FOR TREATING PHYTOPATHOGENIC FUNGI BAYER CROPSCIENCE AG (DE) 2011-10-26 — — EP claimed
US-20100168185-A1 Use of 5-pyridin-4-yl-1,3-thiazoles for controlling phytopathogenic fungi BAYER CORPSCIENCE AG (DE) 2010-07-01 — — US claimed
EP-1368323-B1 PYRIMIDINE MATRIX METALLOPROTEINASE INHIBITORS WARNER LAMBERT CO (US) 2010-06-30 — — EP claimed
WO-2010069494-A1 USE OF 5-PYRIDIN-4YL(1,3)THIAZOLE FOR TREATING PHYTOPATHOGENIC FUNGI BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2010-06-24 — — WO claimed
EP-2198710-A1 Use of 5-pyridin-4yl-(1,3) thiazoles for combating phytopathogenic fungi Bayer CropScience AG (DE) 2010-06-23 — — EP claimed
EP-1884513-A1 PYRAZOLE COMPOUND AND THERAPEUTIC AGENT FOR DIABETES COMPRISING THE SAME Japan Tobacco, Inc. (JP) 2008-02-06 — — EP claimed
EP-1362033-B1 PYRIDINE MATRIX METALLOPROTEINASE INHIBITORS WARNER LAMBERT CO (US) 2007-04-04 — — EP claimed
WO-2002064568-A1 PYRIDINE MATRIX METALLOPROTEINASE INHIBITORS WARNER-LAMBERT COMPANY LLC (US) 2002-08-22 — — WO claimed
WO-2002064571-A1 PYRIMIDINE MATRIX METALLOPROTEINASE INHIBITORS WARNER-LAMBERT COMPANY LLC (US) 2002-08-22 — — WO claimed
CN-1326358-A Method of DNA vaccination GLAXO GROUP LTD (GB) 2001-12-12 — — CN claimed
EP-1146788-A1 AMIDE DERIVATIVES FOR ANTIANGIOGENIC AND/OR ANTITUMORIGENIC USE Vanderbilt University (US) 2001-10-24 — — EP claimed
WO-2001056563-A1 ADAMANTYL DERIVATIVES AS ANTI-CANCER AGENTS GALDERMA RESEARCH & DEVELOPMENT, S.N.C. (FR) 2001-08-09 — — WO claimed
WO-2000040088-A1 AMIDE DERIVATIVES FOR ANTIANGIOGENIC AND/OR ANTITUMORIGENIC USE VANDERBILT UNIVERSITY (US) 2000-07-13 — — WO claimed
CN-1044249-C Matrix metalloprotease inhibitors SYNTEX INC (US) 1999-07-21 — — CN claimed
CN-1134153-A Matrix metalloprotease inhibitors SYNTEX INC (US) 1996-10-23 — — CN claimed
EP-0726903-A1 MATRIX METALLOPROTEASE INHIBITORS SYNTEX INC (US) 1996-08-21 — — EP claimed
WO-1995012603-A1 MATRIX METALLOPROTEASE INHIBITORS________________________________ SYNTEX (U.S.A.) INC. (US) 1995-05-11 — — WO claimed

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-20100168185-A1 Use of 5-pyridin-4-yl-1,3-thiazoles for controlling phytopathogenic fungi PIR, PNPO, PDXK CA1 4653/4885CA2 3318/4885CA12 4741/4885

“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.

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