SCHEMBL4143545

SCHEMBL4143545

N#Cc1cc(C(=O)Nc2cncnc2N)ccc1Oc1ccc(F)cc1

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
EGFR P00533 1/20 0.44
SLC22A12 Q96S37 7/20 0.44
MAPK14 Q16539 3/20 0.43
PLA2G7 Q13093 1/20 0.42
LMNA P02545 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
KCNQ3 O43525 2/20 0.41
KCNQ2 O43526 2/20 0.41
KCNE1 P15382 2/20 0.41
KCNQ1 P51787 2/20 0.41
SCN9A Q15858 1/20 0.40
CYP3A4 P08684 1/20 0.39
CACNA1H O95180 1/20 0.39
CACNA1B Q00975 1/20 0.39
HDAC1 Q13547 1/20 0.39
HDAC2 Q92769 1/20 0.39

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
SCHEMBL13812239 0.85 LMNA (0.41) LMNAKCNQ3KCNQ2KCNE1KCNQ1
SCHEMBL9564871 0.79 HDAC1 (0.54) EGFRLMNASMN1; SMN2KCNQ3KCNQ2
SCHEMBL4151526 0.73 HPGD (0.51) SLC22A12MAPK14PLA2G7
SCHEMBL11237461 0.72 KMT2A (0.55) LMNASMN1; SMN2CYP3A4
SCHEMBL4157702 0.67 SLC22A12 (0.44) SLC22A12SCN9ACYP3A4
SCHEMBL28288017 0.67 KDM4E (0.56) SLC22A12PLA2G7SCN9A
SCHEMBL2534052 0.67 VNN1 (0.54) LMNAL3MBTL1KCNQ3KCNQ2KCNE1
SCHEMBL3142244 0.67 HDAC1 (0.55) LMNASMN1; SMN2L3MBTL1KCNQ3KCNQ2
SCHEMBL4152465 0.66 VNN1 (0.53) L3MBTL1KCNQ3KCNQ2KCNE1KCNQ1
SCHEMBL12412741 0.66 GRM5 (0.54) CYP3A4

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-20090149452-A1 XANTHINE OXIDASE INHIBITOR NIPPON CHEMIPHAR CO., LTD. (JP) 2009-06-11 US disclosed
EP-1911760-A1 XANTHINE OXIDASE INHIBITOR Nippon Chemiphar Co., Ltd. (JP) 2008-04-16 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-20090149452-A1 XANTHINE OXIDASE INHIBITOR XDH, PNPO, CBR1 EGFR 4154/4885SLC22A12 1556/4885MAPK14 2911/4885

“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.