SCHEMBL4876885

SCHEMBL4876885

COC(=O)c1cc(-c2ccccc2)cnc1OC

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AXL P30530 3/20 0.59
MAPT P10636 3/20 0.56
CASP1 P29466 1/20 0.56
MAPK1 P28482 1/20 0.48
SGK1 O00141 1/20 0.47
CAMKK2 Q96RR4 1/20 0.47
PDCD1 Q15116 1/20 0.46
CD274 Q9NZQ7 1/20 0.46
PIK3C3 Q8NEB9 1/20 0.45
PLA2G2A P14555 1/20 0.45
NR4A2 P43354 2/20 0.45
GABRG2 P18507 2/20 0.45
GABRB3 P28472 2/20 0.45
GABRA3 P34903 2/20 0.45
GABRA1 P14867 1/20 0.45
TDP1 Q9NUW8 1/20 0.44
MEN1 O00255 1/20 0.44
ALDH1A1 P00352 1/20 0.44
GAA P10253 1/20 0.44
HPGD P15428 1/20 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
SCHEMBL5687509 0.92 AXL (0.52) AXLMAPTCASP1MAPK1SGK1
SCHEMBL14931747 0.88 MAPT (0.59) AXLMAPTCASP1CAMKK2PIK3C3
SCHEMBL5781938 0.87 NR4A2 (0.54) MAPK1NR4A2GABRG2GABRB3GABRA3
SCHEMBL5778713 0.87 AXL (0.60) AXLPIK3C3NR4A2GABRG2GABRB3
SCHEMBL12427703 0.85 SLC6A4 (0.49) AXLMAPTPIK3C3PLA2G2A
SCHEMBL12427707 0.85 SLC6A3 (0.57) AXLPIK3C3ALDH1A1HPGDPIK3CG
SCHEMBL7093171 0.83 AXL (0.60) AXLMAPTCASP1MAPK1SGK1
SCHEMBL12427702 0.82 CFTR (0.48) AXLMAPTCASP1PIK3C3ALDH1A1
SCHEMBL3713695 0.82 AXL (0.59) AXLMAPTCASP1SGK1CAMKK2
SCHEMBL8623985 0.82 AXL (0.59) AXLMAPTMAPK1SGK1CAMKK2

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
US-8461183-B2 PPAR agonist compounds, preparation and uses GENFIT (FR) 2013-06-11 US disclosed
US-20080200513-A1 Pyridine N-Oxides As Antiviral Agents ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P ANGELETTI SPA (IT) 2008-08-21 US disclosed
EP-1254904-B1 NOVEL PIPERIDINE COMPOUNDS AND DRUGS CONTAINING THE SAME EISAI CO LTD (JP) 2006-05-24 EP disclosed
EP-1635827-A1 PYRIDINE N-OXIDES AS ANTIVIRAL AGENTS ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P. ANGELETTI S.P.A. (IT) 2006-03-22 EP disclosed
WO-2004110442-A1 PYRIDINE N-OXIDES AS ANTIVIRAL AGENTS ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P ANGELETTI SPA (IT) 2004-12-23 WO disclosed
US-6784192-B2 NA+ CHANNEL INHIBITORY ACTION IS USEFUL FOR THERAPY AND PREVENTION FOR EXAMPLE, ARRHYTHMIA, VARIOUS NEURALGIAS AND ANALGESIC EISAI CO., LTD. (JP) 2004-08-31 US disclosed
US-20030220368-A1 Novel piperidine compouds and drugs containing the same EISAI R&D MANAGEMENT CO., LTD. (JP) 2003-11-27 US disclosed
EP-1254904-A1 NOVEL PIPERIDINE COMPOUNDS AND DRUGS CONTAINING THE SAME Eisai Co., Ltd. (JP) 2002-11-06 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-20080200513-A1 Pyridine N-Oxides As Antiviral Agents ZC3HAV1, ZC3HAV1L, HAVCR2 AXL 910/4885MAPT 4848/4885CASP1 916/4885
US-20030220368-A1 Novel piperidine compouds and drugs containing the same TRPV1, CACNA1D, KCND2 AXL 4859/4885MAPT 3180/4885CASP1 553/4885

“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.