SCHEMBL12326742

SCHEMBL12326742

C=C(O)c1cccc(N)c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PBRM1 Q86U86 1/20 0.57
▸ F2 P00734 1/20 0.54
▸ PLG P00747 1/20 0.54
▸ PRSS1 P07477 1/20 0.54
▸ PRSS2 P07478 1/20 0.54
▸ PRSS3 P35030 1/20 0.54
▸ CYP3A4 P08684 1/20 0.50
▸ CASP1 P29466 1/20 0.50
▸ RECQL P46063 1/20 0.50
▸ ALDH1A1 P00352 4/20 0.46
▸ TDP1 Q9NUW8 3/20 0.46
▸ CA12 O43570 1/20 0.46
▸ CA1 P00915 1/20 0.46
▸ CA2 P00918 1/20 0.46
▸ CA7 P43166 1/20 0.46
▸ CA9 Q16790 1/20 0.46
▸ CA14 Q9ULX7 1/20 0.46
▸ MAOA P21397 4/20 0.44
▸ MEN1 O00255 2/20 0.44
▸ GAA P10253 2/20 0.44

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
SCHEMBL19070659 0.83 F2 (0.56) PBRM1F2PLGPRSS1PRSS2
SCHEMBL16396188 0.82 PBRM1 (0.59) PBRM1F2PLGPRSS1PRSS2
SCHEMBL14142782 0.81 F2 (0.59) PBRM1F2PLGPRSS1PRSS2
SCHEMBL771139 0.79 F2 (0.52) PBRM1F2PLGPRSS1PRSS2
SCHEMBL7066984 0.79 PBRM1 (0.60) PBRM1F2PLGPRSS1PRSS2
SCHEMBL3147361 0.77 F2 (0.50) PBRM1F2PLGPRSS1PRSS2
3-Aminobenzoic Acid SCHEMBL27259078 0.77 PBRM1 (0.64) PBRM1F2PLGPRSS1PRSS2
SCHEMBL23480192 0.76 PBRM1 (0.69) PBRM1F2PLGPRSS1PRSS2
3-Aminobenzoic Acid SCHEMBL27648 0.76 PBRM1 (0.69) PBRM1F2PLGPRSS1PRSS2
3-Aminobenzoic Acid SCHEMBL8003706 0.76 PBRM1 (0.69) PBRM1F2PLGPRSS1PRSS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9477148-B1 Polymer, method for preparing the same, and a photosensitive resin composition thereof INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2016-10-25 — — US disclosed
US-9216966-B2 Compounds for Alzheimer's disease Manfredi, John (US) 2015-12-22 — — US disclosed
US-8389767-B2 Processes and compounds SYNGENTA CROP PROTECTION LLC (US) 2013-03-05 — — US disclosed
US-20120309812-A1 INSECTICIDAL COMPOUNDS SYNGENTA CROP PROTECTION LLC (US) 2012-12-06 — — US disclosed
EP-2366699-A1 8-SUBSTITUTED ISOQUINOLINE DERIVATIVE AND USE THEREOF Asahi Kasei Pharma Corporation (JP) 2011-09-21 — — EP disclosed
US-20100240712-A1 INSECTICIDAL COMPOUNDS SYNGENTA CROP PROTECTION, INC. (US) 2010-09-23 — — US disclosed
US-20100204504-A1 NOVEL PROCESSES AND COMPOUNDS SYNGENTA CROP PROTECTION, INC. (US) 2010-08-12 — — 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 (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-20120309812-A1 INSECTICIDAL COMPOUNDS ACHE, AADAC, NISCH PBRM1 3862/4885F2 2179/4885PLG 3093/4885
US-20100204504-A1 NOVEL PROCESSES AND COMPOUNDS DDT, CYP4B1, CYP4F3 PBRM1 3344/4885F2 197/4885PLG 2252/4885
US-20100240712-A1 INSECTICIDAL COMPOUNDS CHRM1, CHRM2, ACHE PBRM1 4781/4885F2 315/4885PLG 4773/4885

“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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