SCHEMBL5211495

SCHEMBL5211495

NC(=O)Nc1cccc(CO)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDK1 Q15118 1/20 0.55
PDK2 Q15119 1/20 0.55
PDK3 Q15120 1/20 0.55
PDK4 Q16654 1/20 0.55
MAPT P10636 3/20 0.49
ALDH1A1 P00352 2/20 0.49
NPC1 O15118 1/20 0.49
LMNA P02545 1/20 0.49
ALOX12 P18054 1/20 0.49
MAPK1 P28482 1/20 0.49
RAB9A P51151 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
GAA P10253 2/20 0.47
GFER P55789 1/20 0.47
NHERF1 O14745 2/20 0.47
CNR2 P34972 1/20 0.47
TRPV1 Q8NER1 1/20 0.46
KDM1A O60341 1/20 0.46
RCOR1 Q9UKL0 1/20 0.46

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
SCHEMBL10647146 0.85 MAPT (0.47) MAPTALDH1A1GAAGFERNOS3
SCHEMBL2557430 0.85 CFD (0.55) MAPTGAAGFERNOS3NOS1
SCHEMBL14052664 0.85 PDK1 (0.58) PDK1PDK2PDK3PDK4MAPT
SCHEMBL4505211 0.84 GAA (0.55) MAPTLMNAGAAGFERPRSS1
SCHEMBL5212905 0.84 MAPT (0.46) MAPTALDH1A1GAAGFERNOS3
SCHEMBL11627789 0.84 CSNK2A1 (0.54) MAPTLMNASMN1; SMN2GAAGFER
SCHEMBL5031452 0.84 SIGMAR1 (0.60) MAPTALDH1A1NPC1LMNAMAPK1
SCHEMBL13564689 0.84 MAPT (0.46) PDK1PDK2PDK3PDK4MAPT
SCHEMBL1028484 0.83 PDK1 (0.56) PDK1PDK2PDK3PDK4MAPT
SCHEMBL11601488 0.82 SELP (0.60) MAPTGAAGFERITGB3ITGA2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250304576-A1 IKK INHIBITORS CANCER RESEARCH TECH LTD (GB) 2025-10-02 US disclosed
CN-102799085-B Electrophotographic photosensitive member, process cartridge, electrophotographic apparatus, method of producing electrophotographic photosensitive member, and urea compound CANON KK 2014-12-03 CN disclosed
CN-102799085-A Electrophotographic photosensitive member, process cartridge, electrophotographic apparatus, method of producing electrophotographic photosensitive member, and urea compound CANON KK 2012-11-28 CN disclosed
EP-1554264-B1 MEDICINAL ARYLETHANOLAMINE COMPOUNDS GLAXO GROUP LTD (GB) 2007-08-08 EP disclosed
US-20060205790-A1 Medicinal arylethanolamine compounds GLAXO GROUP LIMITED (GB) 2006-09-14 US disclosed
EP-1554264-A2 MEDICINAL ARYLETHANOLAMINE COMPOUNDS GLAXO GROUP LIMITED (GB) 2005-07-20 EP disclosed
WO-2004037807-A9 MEDICINAL ARYLETHANOLAMINE COMPOUNDS GLAXO GROUP LTD (GB) 2004-08-19 WO disclosed
WO-2004037807-A2 MEDICINAL ARYLETHANOLAMINE COMPOUNDS GLAXO GROUP LIMITED (GB) 2004-05-06 WO disclosed
EP-0804425-A2 BENZODIAZEPINE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1997-11-05 EP 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 (2 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-20250304576-A1 IKK INHIBITORS NFKBIA, IKBKE, IKBKB PDK1 199/4885PDK2 1792/4885PDK3 1318/4885
US-20060205790-A1 Medicinal arylethanolamine compounds NAT1, AADAC, AHR PDK1 2018/4885PDK2 1702/4885PDK3 1817/4885

“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.