SCHEMBL14875446

SCHEMBL14875446

COCCNCc1ccncc1N

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AOC1 P19801 4/20 0.49
▸ AOC3 Q16853 4/20 0.49
▸ HTT P42858 1/20 0.45
▸ ALDH1A1 P00352 2/20 0.41
▸ KDM4E B2RXH2 1/20 0.41
▸ GLA P06280 1/20 0.41
▸ GAA P10253 1/20 0.41
▸ BRAF P15056 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ PDCD1 Q15116 1/20 0.36
▸ CD274 Q9NZQ7 1/20 0.36
▸ BACE1 P56817 1/20 0.36
▸ BACE2 Q9Y5Z0 1/20 0.36
▸ NOS3 P29474 1/20 0.36
▸ NOS1 P29475 1/20 0.36
▸ TBK1 Q9UHD2 1/20 0.36
▸ NAMPT P43490 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ P4HTM Q9NXG6 1/20 0.35
▸ MAPT P10636 1/20 0.35

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
SCHEMBL18678314 0.77 NAMPT (0.47) HTTALDH1A1BRAFPDCD1CD274
SCHEMBL22716808 0.76 HTT (0.50) HTTL3MBTL1SMN1; SMN2MAPT
SCHEMBL8357660 0.75 AOC1 (0.59) AOC1AOC3ALDH1A1KDM4EGLA
SCHEMBL2551503 0.75 PTGER4 (0.49) AOC1AOC3ALDH1A1KDM4EGLA
SCHEMBL2567290 0.74 L3MBTL1 (0.57) HTTALDH1A1KDM4EGLAGAA
SCHEMBL6340679 0.73 HTT (0.55) HTTALDH1A1KDM4EGAAL3MBTL1
SCHEMBL14576594 0.72 PTGER4 (0.46) AOC1AOC3ALDH1A1KDM4EGLA
SCHEMBL5113242 0.72 CYP1A2 (0.65) HTTALDH1A1GAAP4HTM
SCHEMBL6272033 0.72 HTT (0.50) HTTALDH1A1KDM4EGAAL3MBTL1
Hydrochloric Acid SCHEMBL6336429 0.72 HTT (0.58) HTTALDH1A1KDM4EGAAL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9227967-B2 Inhibitor compounds of semicarbazide-sensitive amine oxidases PROXIMAGEN LIMITED (GB) 2016-01-05 — — US disclosed
US-9227967-B2 Inhibitor compounds of semicarbazide-sensitive amine oxidases PROXIMAGEN LIMITED (GB) 2016-01-05 — — US disclosed
US-9227967-B2 Inhibitor compounds of semicarbazide-sensitive amine oxidases PROXIMAGEN LIMITED (GB) 2016-01-05 — — US disclosed
EP-2927233-A1 INHIBITORS OF SEMICARBAZIDE-SENSITIVE AMINE OXIDASE Proximagen Limited (GB) 2015-10-07 — — EP disclosed
EP-2927233-A1 INHIBITORS OF SEMICARBAZIDE-SENSITIVE AMINE OXIDASE Proximagen Limited (GB) 2015-10-07 — — EP disclosed
EP-2547677-B1 INHIBITORS OF SEMICARBAZIDE-SENSITIVE AMINE OXIDASE PROXIMAGEN LTD (GB) 2015-05-06 — — EP disclosed
EP-2547677-B1 INHIBITORS OF SEMICARBAZIDE-SENSITIVE AMINE OXIDASE PROXIMAGEN LTD (GB) 2015-05-06 — — EP disclosed
US-20130102587-A1 New Enzyme Inhibitor Compounds PROXIMAGEN LIMITED (GB) 2013-04-25 — — US disclosed
US-20130102587-A1 New Enzyme Inhibitor Compounds PROXIMAGEN LIMITED (GB) 2013-04-25 — — US disclosed
US-20130102587-A1 New Enzyme Inhibitor Compounds PROXIMAGEN LIMITED (GB) 2013-04-25 — — 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 (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-20130102587-A1 New Enzyme Inhibitor Compounds SERPINB1, SSB, NFKBIA AOC1 95/4885AOC3 154/4885HTT 3547/4885

“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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