SCHEMBL6699267

SCHEMBL6699267

Cc1nc2ncc(C(=O)NCc3ccc(Cl)cc3)c(O)c2cc1CC1CCOCC1

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.42
RXFP1 Q9HBX9 1/20 0.42
LMNA P02545 2/20 0.41
ALDH1A1 P00352 1/20 0.41
TSHR P16473 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
CNR2 P34972 7/20 0.41
CYP1A2 P05177 3/20 0.41
CYP3A4 P08684 3/20 0.41
CYP2C9 P11712 3/20 0.41
EGLN1 Q9GZT9 1/20 0.41
CYP1A1 P04798 1/20 0.40
HPGD P15428 1/20 0.40
NR3C1 P04150 2/20 0.40
CYP2C19 P33261 2/20 0.40
CNR1 P21554 1/20 0.40
CYP2D6 P10635 1/20 0.40
PDE4B Q07343 1/20 0.40

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
SCHEMBL6692811 0.85 KCNH2 (0.51) RXFP1ALDH1A1TSHR
SCHEMBL7841422 0.82 MAPK1 (0.45) MAPK1RXFP1CNR2CYP1A2CYP3A4
SCHEMBL6766761 0.80 MAPK1 (0.45) MAPK1RXFP1LMNACNR2CYP1A2
SCHEMBL6666276 0.79 EGLN1 (0.47) MAPK1RXFP1CNR2CYP1A2CYP3A4
SCHEMBL6697405 0.79 EGLN1 (0.47) LMNAALDH1A1TSHRSMN1; SMN2EGLN1
SCHEMBL6696378 0.79 EGLN1 (0.47) LMNAALDH1A1TSHRSMN1; SMN2EGLN1
SCHEMBL6691160 0.78 LMNA (0.47) LMNAALDH1A1TSHRSMN1; SMN2EGLN1
SCHEMBL6713866 0.77 EGLN1 (0.46) MAPK1RXFP1LMNACNR2CYP1A2
SCHEMBL6695156 0.76 ADORA2A (0.57) LMNAALDH1A1TSHRSMN1; SMN2CYP1A2
SCHEMBL6699580 0.75 EGLN1 (0.43) LMNAALDH1A1TSHRSMN1; SMN2EGLN1

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
US-20040067947-A1 Method of preventing or treating atherosclerosis or restenosis WATHEN MICHAEL W 2004-04-08 US claimed
EP-1265896-A1 4-HYDROXY-1,8-NAPHTHYRIDINE-3-CARBOXAMIDES AS ANTIVIRAL AGENTS PHARMACIA & UPJOHN COMPANY (US) 2002-12-18 EP claimed
US-6413958-B2 FOR TREATMENT/PREVENTION OF INFECTION OF HERPES SIMPLEX VIRUS, VARICELLA ZOSTER VIRUS, HUMAN CYTOMEGALOVIRUS, OR EPSTEIN-BARR VIRUS; ENZYME INHIBITORS PHARMACIA & UPJOHN COMPANY 2002-07-02 US claimed
US-20020007066-A1 4-hydroxy-1,8-naphthyridine-3-carboxamides as antiviral agents PHARMACIA & UPJOHN COMPANY 2002-01-17 US claimed
WO-2001070742-A1 4-HYDROXY-1,8-NAPHTHYRIDINE-3-CARBOXAMIDES AS ANTIVIRAL AGENTS PHARMACIA & UPJOHN COMPANY (US) 2001-09-27 WO claimed
US-20040067947-A1 Method of preventing or treating atherosclerosis or restenosis WATHEN MICHAEL W 2004-04-08 US disclosed
EP-1265896-A1 4-HYDROXY-1,8-NAPHTHYRIDINE-3-CARBOXAMIDES AS ANTIVIRAL AGENTS PHARMACIA & UPJOHN COMPANY (US) 2002-12-18 EP disclosed
US-6413958-B2 FOR TREATMENT/PREVENTION OF INFECTION OF HERPES SIMPLEX VIRUS, VARICELLA ZOSTER VIRUS, HUMAN CYTOMEGALOVIRUS, OR EPSTEIN-BARR VIRUS; ENZYME INHIBITORS PHARMACIA & UPJOHN COMPANY 2002-07-02 US disclosed
US-20020007066-A1 4-hydroxy-1,8-naphthyridine-3-carboxamides as antiviral agents PHARMACIA & UPJOHN COMPANY 2002-01-17 US disclosed
WO-2001070742-A1 4-HYDROXY-1,8-NAPHTHYRIDINE-3-CARBOXAMIDES AS ANTIVIRAL AGENTS PHARMACIA & UPJOHN COMPANY (US) 2001-09-27 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 (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-20020007066-A1 4-hydroxy-1,8-naphthyridine-3-carboxamides as antiviral agents CNR1, HAVCR2, NR1H4 MAPK1 3165/4885RXFP1 2426/4885LMNA 1449/4885
US-20040067947-A1 Method of preventing or treating atherosclerosis or restenosis LDLR, MSR1, NR1H2 MAPK1 737/4885RXFP1 153/4885LMNA 528/4885

“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.