SCHEMBL4558889

SCHEMBL4558889

Cc1nc2cnc(Cl)cc2c(=O)o1

nearest known ligand 0.54

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ELANE P08246 10/20 0.54
ALDH1A1 P00352 3/20 0.33
KDM4E B2RXH2 2/20 0.33
KCNA3 P22001 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
LMNA P02545 1/20 0.33
MAPT P10636 1/20 0.33
C1R P00736 3/20 0.32

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
SCHEMBL757536 0.78 ELANE (0.72) ELANEALDH1A1KDM4EKCNA3MEN1
SCHEMBL757103 0.76 ELANE (0.70) ELANEALDH1A1KDM4EKCNA3MEN1
SCHEMBL31000399 0.75 ELANE (0.70) ELANEALDH1A1KDM4EMEN1KMT2A
SCHEMBL1812732 0.75 ELANE (0.70) ELANEALDH1A1KDM4EMEN1KMT2A
SCHEMBL12352010 0.73 ELANE (0.66) ELANEALDH1A1KDM4EKCNA3MEN1
SCHEMBL30089879 0.71 ELANE (0.59) ELANEALDH1A1KDM4EKMT2ALMNA
SCHEMBL4482739 0.71 ELANE (0.59) ELANEALDH1A1KDM4EKMT2ALMNA
SCHEMBL4117968 0.70 ELANE (1.00) ELANEALDH1A1KDM4EMEN1KMT2A
SCHEMBL24804872 0.70 KDM4E (0.53) ALDH1A1KDM4ELMNAMAPT
SCHEMBL4458738 0.70 ELANE (0.42) ELANEALDH1A1KDM4EMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1717230-B1 FUSED-RING 4-OXOPYRIMIDINE DERIVATIVE MSD KK (JP) 2014-08-06 EP disclosed
US-8268842-B2 Fused ring 4-oxopyrimidine derivative MSD K.K. (JP) 2012-09-18 US disclosed
US-20090209562-A1 Fused ring 4-oxopyrimidine derivative BANYU PHARMACEUTICAL CO., LTD. (JP) 2009-08-20 US disclosed
US-7521455-B2 Fused ring 4-oxopyrimidine derivative BANYU PHARMACEUTICAL CO. LTD. (JP) 2009-04-21 US disclosed
EP-1717230-A1 FUSED-RING 4-OXOPYRIMIDINE DERIVATIVE BANYU PHARMACEUTICAL CO., LTD. (JP) 2006-11-02 EP disclosed
US-20050182045-A1 Fused ring 4-oxopyrimidine derivative BANYU PHARMACEUTICAL CO., LTD. (JP) 2005-08-18 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 (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-20050182045-A1 Fused ring 4-oxopyrimidine derivative HRH4, HRH2, HRH3 ELANE 4447/4885ALDH1A1 1717/4885KDM4E 1674/4885
US-20090209562-A1 Fused ring 4-oxopyrimidine derivative HRH4, HRH2, HRH3 ELANE 4447/4885ALDH1A1 1717/4885KDM4E 1674/4885

“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.