SCHEMBL19063445

SCHEMBL19063445

CC(=O)c1ncc(C#CC2CC2)cc1Cl

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ EGLN1 Q9GZT9 2/20 0.49
▸ CHRNB2 P17787 2/20 0.39
▸ CHRNA2 Q15822 2/20 0.39
▸ CHRNB4 P30926 1/20 0.39
▸ CHRNA3 P32297 1/20 0.39
▸ CHRNA4 P43681 1/20 0.39
▸ PDGFRB P09619 1/20 0.38
▸ PDGFRA P16234 1/20 0.38
▸ EGLN3 Q9H6Z9 1/20 0.35
▸ OGA O60502 7/20 0.35
▸ GRM5 P41594 1/20 0.35
▸ FFAR1 O14842 1/20 0.35
▸ PGK1 P00558 1/20 0.33
▸ PTGES O14684 2/20 0.33
▸ BACE1 P56817 1/20 0.32
▸ BACE2 Q9Y5Z0 1/20 0.32

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
SCHEMBL18335149 0.82 EGLN1 (0.49) EGLN1CHRNB2CHRNA2CHRNB4CHRNA3
SCHEMBL19063456 0.80 EGLN1 (0.46) EGLN1EGLN3GRM5
SCHEMBL18335073 0.77 EGLN1 (0.44) EGLN1CHRNB2CHRNA2CHRNB4CHRNA3
SCHEMBL18335098 0.77 EGLN1 (0.44) EGLN1CHRNB2CHRNA2CHRNB4CHRNA3
SCHEMBL18335169 0.77 EGLN1 (0.40) EGLN1CHRNB2CHRNA2CHRNB4CHRNA3
SCHEMBL15900548 0.75 EGLN1 (0.53) EGLN1CHRNB2CHRNA2CHRNB4CHRNA3
SCHEMBL16432336 0.74 FFAR1 (0.42) EGLN1GRM5FFAR1PTGESBACE1
SCHEMBL18335118 0.73 EGLN1 (0.41) EGLN1GRM5
SCHEMBL31044571 0.72 EGLN1 (0.50) EGLN1CHRNB2CHRNA2CHRNB4CHRNA3
SCHEMBL18335074 0.72 MEN1 (0.46) EGLN1CHRNB2CHRNA2CHRNB4CHRNA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10231454-B2 Fungicidal or bactericidal composition, and method for controlling diseases NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2019-03-19 — — US disclosed
US-20180220655-A1 FUNGICIDAL OR BACTERICIDAL COMPOSITION, AND METHOD FOR CONTROLLING DISEASES NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2018-08-09 — — US disclosed
US-9974305-B2 Fungicidal or bactericidal composition, and method for controlling diseases NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2018-05-22 — — US disclosed
US-20170188580-A1 FUNGICIDAL OR BACTERICIDAL COMPOSITION, AND METHOD FOR CONTROLLING DISEASES NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2017-07-06 — — 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-20180220655-A1 FUNGICIDAL OR BACTERICIDAL COMPOSITION, AND METHOD FOR CONTROLLING DISEASES NOX3, TH, CBR3 EGLN1 238/4885CHRNB2 1827/4885CHRNA2 2894/4885
US-10231454-B2 Fungicidal or bactericidal composition, and method for controlling diseases NOX3, TH, CBR3 EGLN1 238/4885CHRNB2 1827/4885CHRNA2 2894/4885
US-20170188580-A1 FUNGICIDAL OR BACTERICIDAL COMPOSITION, AND METHOD FOR CONTROLLING DISEASES NOX3, TH, CBR3 EGLN1 238/4885CHRNB2 1827/4885CHRNA2 2894/4885

“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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