SCHEMBL7067358

SCHEMBL7067358

O=C(O)c1c(O)ccnc1O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 2/20 0.50
CA1 P00915 2/20 0.50
CA2 P00918 2/20 0.50
CA7 P43166 2/20 0.50
CA9 Q16790 2/20 0.50
CA14 Q9ULX7 2/20 0.50
KDM4E B2RXH2 9/20 0.39
ASPH Q12797 2/20 0.39
KDM8 Q8N371 2/20 0.39
NAPRT Q6XQN6 3/20 0.39
L3MBTL1 Q9Y468 4/20 0.39
KDM4A O75164 3/20 0.39
EGLN1 Q9GZT9 3/20 0.39
HIF1AN Q9NWT6 2/20 0.39
RAB9A P51151 1/20 0.39
ALDH1A1 P00352 4/20 0.38
KDM4C Q9H3R0 3/20 0.38
KDM3A Q9Y4C1 3/20 0.38
KDM6B O15054 2/20 0.38
TET3 O43151 2/20 0.38

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
SCHEMBL19857476 0.80 KDM4E (0.52) CA12CA1CA2CA7CA9
SCHEMBL18741706 0.80 KDM4E (0.41) CA12CA1CA2CA7CA9
SCHEMBL1002512 0.80 KDM4E (0.52) CA12CA1CA2CA7CA9
SCHEMBL5355271 0.78 NAPRT (0.47) CA12CA1CA2CA7CA9
SCHEMBL10766873 0.78 CYP3A4 (0.39) CA12CA1CA2CA7CA9
SCHEMBL10765922 0.78 KDM4E (0.46) CA12CA1CA2CA7CA9
SCHEMBL1137039 0.78 KDM4E (0.42) CA12CA1CA2CA7CA9
SCHEMBL10762405 0.78 DPP4 (0.52) CA12CA1CA2CA7CA9
SCHEMBL3112069 0.78 KDM4E (0.50) CA12CA1CA2CA7CA9
SCHEMBL30639525 0.78 CA12 (0.46) CA12CA1CA2CA7CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118206481-A Right-embedded alcohol or fenchyl alcohol ester derivatives of 2-hydroxy nicotinic acid and pharmaceutical application thereof 苏州南医大创新中心 2024-06-18 CN disclosed
US-20030018012-A1 Fungicidal heterocyclic aromatic amides and their compositions, methods of use and preparation RICKS MICHAEL J (US) 2003-01-23 US disclosed
EP-1196388-A2 FUNGICIDAL HETEROCYCLIC AROMATIC AMIDES AND THEIR COMPOSITIONS, METHODS OF USE AND PREPARATION Dow AgroSciences LLC (US) 2002-04-17 EP disclosed
WO-2001005769-A2 FUNGICIDAL HETEROCYCLIC AROMATIC AMIDES AND THEIR COMPOSITIONS, METHODS OF USE AND PREPARATION DOW AGROSCIENCES LLC (US) 2001-01-25 WO disclosed
US-4346076-A Bis-tetrazoylmethyl substituted cephalosporin antibiotics ELI LILLY AND COMPANY (US) 1982-08-24 US disclosed
EP-0048165-A1 Bis-tetrazolemethyl substituted beta-lactam antibiotics, their preparation and pharmaceutical formulations containing them ELI LILLY AND COMPANY (US) 1982-03-24 EP disclosed
EP-0048169-A2 Bis-tetrazoylmethyl substituted cephalosporin antibiotics, their preparation and pharmaceutical formulations containing them ELI LILLY AND COMPANY (US) 1982-03-24 EP disclosed
US-4304774-A Bis-tetrazolmethyl substituted β-lactam antibiotics ELI LILLY AND COMPANY (US) 1981-12-08 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-20030018012-A1 Fungicidal heterocyclic aromatic amides and their compositions, methods of use and preparation CYP4X1, CYP1A1, NAT1 CA12 2199/4885CA1 653/4885CA2 463/4885

“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.