SCHEMBL4921409

SCHEMBL4921409

COc1cccc(CNc2ncnc3c2oc2nc(N(C)C)c4c(c23)CC(C)(C)OC4)c1OC

nearest known ligand 0.57

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 12/20 0.57
HSD17B10 Q99714 8/20 0.57
HPGD P15428 8/20 0.57
KDM4E B2RXH2 8/20 0.57
MAPK1 P28482 5/20 0.57
MEN1 O00255 3/20 0.57
KMT2A Q03164 3/20 0.57
USP2 O75604 1/20 0.57
TSHR P16473 2/20 0.52
CREBBP Q92793 1/20 0.52
PDE4B Q07343 5/20 0.49
HKDC1 Q2TB90 6/20 0.49
RAB9A P51151 1/20 0.49
HTT P42858 1/20 0.48
PDE4A P27815 3/20 0.46
PDE4D Q08499 3/20 0.46
L3MBTL1 Q9Y468 1/20 0.42

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
SCHEMBL4923993 0.85 ALDH1A1 (0.59) ALDH1A1HSD17B10HPGDKDM4EMAPK1
SCHEMBL4914572 0.85 PDE4B (0.70) ALDH1A1HSD17B10HPGDKDM4EMAPK1
SCHEMBL4708117 0.76 PDE4B (0.69) PDE4BPDE4APDE4D
SCHEMBL4914020 0.74 ALDH1A1 (0.58) ALDH1A1HSD17B10HPGDKDM4EMAPK1
SCHEMBL5011337 0.73 PDE4B (0.78) ALDH1A1HPGDKDM4EKMT2APDE4B
SCHEMBL4049077 0.72 PDE4B (0.63) ALDH1A1HPGDKDM4EKMT2APDE4B
SCHEMBL4045300 0.70 PDE4B (0.51) ALDH1A1HPGDKDM4EMAPK1KMT2A
SCHEMBL4917120 0.69 PDE4B (0.72) ALDH1A1HSD17B10HPGDKDM4EMAPK1
SCHEMBL4046383 0.68 PDE4B (0.54) ALDH1A1HPGDKDM4EKMT2APDE4B
SCHEMBL4922646 0.68 ALDH1A1 (0.56) ALDH1A1HSD17B10HPGDKDM4EMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080221096-A1 Pyrido[3' ,2':4,5]Furo[3,2-d]Pyrimidine Derivatives LABORATORIOS ALMIRALL, S.A. (ES) 2008-09-11 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 (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-20080221096-A1 Pyrido[3' ,2':4,5]Furo[3,2-d]Pyrimidine Derivatives NR1H2, CBR3, NR4A1 ALDH1A1 2625/4885HSD17B10 472/4885HPGD 1978/4885

“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.