SCHEMBL5459562

SCHEMBL5459562

COC(=O)c1cc(-c2c(-c3ccc(F)cc3)nn3c(Cl)cccc23)nc(NC2CCCC2)n1

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 5/20 0.44
MAPT P10636 2/20 0.36
KDM4E B2RXH2 1/20 0.35
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C9 P11712 1/20 0.35
HPGD P15428 1/20 0.35
CYP2C19 P33261 1/20 0.35
PTGS2 P35354 3/20 0.35
PTGS1 P23219 2/20 0.35
ALOX5 P09917 1/20 0.35
AGER Q15109 1/20 0.35
CSNK1D P48730 1/20 0.34
FAAH O00519 1/20 0.34
MGLL Q99685 1/20 0.34

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
SCHEMBL5448946 0.92 MAPK14 (0.46) MAPK14KDM4EPTGS2PTGS1ALOX5
SCHEMBL5457461 0.90 MAPK14 (0.44) MAPK14MAPTKDM4E
SCHEMBL5455164 0.86 MAPK14 (0.48) MAPK14KDM4EPTGS2PTGS1ALOX5
SCHEMBL6184414 0.86 MAPK14 (0.43) MAPK14MAPTKDM4EALDH1A1LMNA
SCHEMBL5455132 0.85 MAPK14 (0.48) MAPK14MAPTKDM4EALDH1A1LMNA
SCHEMBL5457274 0.84 MAPK14 (0.46) MAPK14MAPTKDM4EALOX5CSNK1D
SCHEMBL5460496 0.82 MAPK14 (0.46) MAPK14MAPTKDM4EALOX5CSNK1D
SCHEMBL5455260 0.82 MAPK14 (0.44) MAPK14PTGS2PTGS1ALOX5CSNK1D
SCHEMBL5452140 0.82 NPC1 (0.43) MAPK14MAPTKDM4E
SCHEMBL5461798 0.81 MAPK14 (0.53) MAPK14CSNK1D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070287721-A1 Pyrazolopyridinyl pyridine BOYD F LESLIE 2007-12-13 US disclosed
EP-1377573-B1 PYRAZOLOPYRIDINE DERIVATIVES GLAXO GROUP LTD (GB) 2005-07-27 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 (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-20070287721-A1 Pyrazolopyridinyl pyridine CYP3A5, CYP2C19, CYP3A4 MAPK14 2533/4885MAPT 1659/4885KDM4E 1789/4885

“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.