SCHEMBL1286522

SCHEMBL1286522

NC(=O)c1cccc(-c2c(C(N)=O)c(C(N)=O)c3c4ccc(cc4)c3c2-c2cccc(C(N)=O)c2C(N)=O)c1C(N)=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 1/20 0.41
NFE2L2 Q16236 1/20 0.41
HSD17B10 Q99714 2/20 0.39
BCAT2 O15382 1/20 0.39
PDK2 Q15119 2/20 0.38
PARP1 P09874 8/20 0.36
KDM4E B2RXH2 2/20 0.36
ALDH1A1 P00352 2/20 0.36
GAA P10253 1/20 0.36
PDPK1 O15530 1/20 0.35
CSNK1A1 P48729 2/20 0.35
DYRK1B Q9Y463 2/20 0.35
TYRO3 Q06418 1/20 0.35
MAPT P10636 1/20 0.34
HPGD P15428 1/20 0.34
TSHR P16473 1/20 0.34
PLK4 O00444 1/20 0.33
CHEK1 O14757 1/20 0.33
AURKA O14965 1/20 0.33
DAPK3 O43293 1/20 0.33

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
SCHEMBL9284288 0.83 BCAT2 (0.47) KEAP1NFE2L2HSD17B10BCAT2PDK2
SCHEMBL8675281 0.82 KEAP1 (0.56) KEAP1NFE2L2HSD17B10BCAT2PDK2
SCHEMBL402013 0.79 BCAT2 (0.56) KEAP1NFE2L2HSD17B10BCAT2PDK2
SCHEMBL7524098 0.75 BCAT2 (0.46) KEAP1NFE2L2BCAT2PDK2PARP1
SCHEMBL28309606 0.74 KEAP1 (0.44) KEAP1NFE2L2BCAT2PDK2PARP1
SCHEMBL5608858 0.74 BCAT2 (0.61) KEAP1NFE2L2HSD17B10BCAT2PDK2
SCHEMBL28442421 0.72 SLC6A2 (0.46) KEAP1NFE2L2BCAT2PARP1KDM4E
SCHEMBL466296 0.71 KDM4E (0.54) KEAP1NFE2L2HSD17B10BCAT2PARP1
SCHEMBL8910680 0.70 KDM4E (0.51) KEAP1NFE2L2HSD17B10BCAT2PARP1
SCHEMBL901580 0.69 BCAT2 (0.71) KEAP1NFE2L2HSD17B10BCAT2PARP1

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-4622265-A COPOLYAMIDES KOREA ADVANCED INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 1986-11-11 US claimed
US-8674134-B2 Oligomer functionalized nanotubes and composites formed therewith THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2014-03-18 US disclosed
US-20120088934-A1 OLIGOMER FUNCTIONALIZED NANOTUBES AND COMPOSITES FORMED THEREWITH THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2012-04-12 US disclosed
EP-0329591-B1 PNEUMATIC TIRES THE GOODYEAR TIRE & RUBBER COMPANY (US) 1993-07-14 EP disclosed
EP-0296093-B1 PNEUMATIC TIRES THE GOODYEAR TIRE & RUBBER COMPANY (US) 1991-07-31 EP disclosed
EP-0329591-A2 Pneumatic tires THE GOODYEAR TIRE & RUBBER COMPANY (US) 1989-08-23 EP disclosed
US-4832102-A Pneumatic tires THE GOODYEAR TIRE & RUBBER COMPANY (US) 1989-05-23 US disclosed
US-4832103-A Pneumatic tire having plural aramid carcass plies THE GOODYEAR TIRE & RUBBER COMPANY (US) 1989-05-23 US disclosed
US-4622265-A COPOLYAMIDES KOREA ADVANCED INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 1986-11-11 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-20120088934-A1 OLIGOMER FUNCTIONALIZED NANOTUBES AND COMPOSITES FORMED THEREWITH TNS4, ILK, PFAS KEAP1 2863/4885NFE2L2 3259/4885HSD17B10 4807/4885

“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.