SCHEMBL6814201

SCHEMBL6814201

CCOC(=O)c1cn(C)c2ccc(CN3CCOCC3)cc2c1=O

nearest known ligand 0.64

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.50
KDM4E B2RXH2 1/20 0.50
HPGD P15428 1/20 0.50
HSD17B10 Q99714 1/20 0.50
TP53 P04637 1/20 0.49
LMNA P02545 3/20 0.48
TSHR P16473 3/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
MAPT P10636 1/20 0.48
MAPK1 P28482 1/20 0.48
STAT3 P40763 1/20 0.48
RAB9A P51151 1/20 0.48
USP2 O75604 1/20 0.47
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
NPSR1 Q6W5P4 1/20 0.44
KCNH2 Q12809 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
SCHEMBL7929460 0.88 ALDH1A1 (0.48) ALDH1A1KDM4EHPGDHSD17B10LMNA
SCHEMBL7929462 0.86 ALDH1A1 (0.47) ALDH1A1KDM4EHPGDHSD17B10LMNA
SCHEMBL6813886 0.86 LMNA (0.63) ALDH1A1TP53LMNATSHRUSP2
SCHEMBL6709496 0.85 NPSR1 (0.51) ALDH1A1KDM4EHPGDHSD17B10LMNA
SCHEMBL6709588 0.85 ALDH1A1 (0.51) ALDH1A1KDM4EHPGDHSD17B10TP53
SCHEMBL7846034 0.85 ALDH1A1 (0.47) ALDH1A1KDM4EHPGDHSD17B10LMNA
SCHEMBL7938737 0.85 ALDH1A1 (0.45) ALDH1A1KDM4EHPGDHSD17B10LMNA
SCHEMBL6710797 0.84 ALDH1A1 (0.47) ALDH1A1KDM4EHPGDHSD17B10LMNA
SCHEMBL6709410 0.84 NPC1 (0.48) ALDH1A1KDM4EHPGDHSD17B10LMNA
SCHEMBL17896908 0.84 GRM2 (0.57) ALDH1A1KDM4EHPGDHSD17B10LMNA

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
EP-1140851-B1 4-OXO-1,4-DIHYDRO-3-QUINOLINECARBOXAMIDES AS ANTIVIRAL AGENTS UPJOHN CO (US) 2004-09-01 EP claimed
US-20030212271-A1 Trifluoroacetic acid process to prepare [2,3-B]pyridine intermediates PHARMACIA & UPJOHN COMPANY 2003-11-13 US claimed
WO-2003089437-A1 A TRIFLUOROACETIC ACID PROCESS TO PREPARE [2,3-B]PYRIDINE INTERMEDIATES PHARMACIA & UPJOHN COMPANY (US) 2003-10-30 WO claimed
EP-1140851-A1 4-OXO-1,4-DIHYDRO-3-QUINOLINECARBOXAMIDES AS ANTIVIRAL AGENTS PHARMACIA & UPJOHN COMPANY (US) 2001-10-10 EP claimed
US-6248736-B1 DNA POLYMERASE INHIBITORS EFFECTIVE AGAINST HERPESVIRUSES PHARMACIA & UPJOHN COMPANY 2001-06-19 US claimed
WO-2000040563-A1 4-OXO-1,4-DIHYDRO-3-QUINOLINECARBOXAMIDES AS ANTIVIRAL AGENTS PHARMACIA & UPJOHN COMPANY (US) 2000-07-13 WO claimed
EP-1140851-B1 4-OXO-1,4-DIHYDRO-3-QUINOLINECARBOXAMIDES AS ANTIVIRAL AGENTS UPJOHN CO (US) 2004-09-01 EP disclosed
EP-1140851-A1 4-OXO-1,4-DIHYDRO-3-QUINOLINECARBOXAMIDES AS ANTIVIRAL AGENTS PHARMACIA & UPJOHN COMPANY (US) 2001-10-10 EP disclosed
US-6248736-B1 DNA POLYMERASE INHIBITORS EFFECTIVE AGAINST HERPESVIRUSES PHARMACIA & UPJOHN COMPANY 2001-06-19 US disclosed
WO-2000040563-A1 4-OXO-1,4-DIHYDRO-3-QUINOLINECARBOXAMIDES AS ANTIVIRAL AGENTS PHARMACIA & UPJOHN COMPANY (US) 2000-07-13 WO 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-20030212271-A1 Trifluoroacetic acid process to prepare [2,3-B]pyridine intermediates AP2A2, MAL2, AP2A1 ALDH1A1 390/4885KDM4E 3895/4885HPGD 1749/4885

“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.