SCHEMBL6288676

SCHEMBL6288676

COc1cc(CNc2nc(-c3ccc(OC)c(OC)c3)nn3c(C)nc(C)c23)cc(OC)c1

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CSNK1D P48730 1/20 0.45
TP53 P04637 4/20 0.40
MAPT P10636 4/20 0.40
KDM4E B2RXH2 3/20 0.40
ALDH1A1 P00352 3/20 0.40
HPGD P15428 3/20 0.40
SMN1; SMN2 Q16637 3/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
HTT P42858 1/20 0.40
NPSR1 Q6W5P4 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
GAA P10253 1/20 0.39
TSHR P16473 1/20 0.39
GSK3B P49841 1/20 0.38
FYN P06241 1/20 0.37
CDK1 P06493 1/20 0.37
NR1H4 Q96RI1 1/20 0.37
RAB9A P51151 1/20 0.36

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
SCHEMBL6288637 0.84 KDM4E (0.45) CSNK1DTP53MAPTKDM4EALDH1A1
SCHEMBL6286594 0.84 KMT2A (0.48) CSNK1DTP53MAPTKDM4EALDH1A1
SCHEMBL6288409 0.80 ABCG2 (0.48) TP53MAPTKDM4EALDH1A1HPGD
SCHEMBL6288383 0.80 MEN1 (0.44) MAPTKDM4EALDH1A1SMN1; SMN2MEN1
SCHEMBL6291373 0.78 MAPT (0.46) MAPTKDM4EMEN1KMT2AHTT
SCHEMBL6287805 0.76 PLK1 (0.45) TP53MAPTSMN1; SMN2MEN1KMT2A
SCHEMBL6291353 0.76 ALDH1A1 (0.40) CSNK1DMAPTKDM4EALDH1A1HPGD
SCHEMBL6288410 0.75 ABCG2 (0.42) TP53MAPTSMN1; SMN2RAB9A
SCHEMBL6288423 0.74 ALOX15 (0.46) TP53MAPTMEN1KMT2AGAA
SCHEMBL6291840 0.73 ABCG2 (0.44) CSNK1DTP53MAPTHPGDSMN1; SMN2

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-6936609-B2 Imidazotriazines for use as phosphodiesterase inhibitors BAYER HEALTHCARE AG (DE) 2005-08-30 US disclosed
US-20040249148-A1 Imidazotriazines for use as phosphodiesterase inhibitors BAYER HEALTHCARE AG (DE) 2004-12-09 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-20040249148-A1 Imidazotriazines for use as phosphodiesterase inhibitors PDE3A, PDE2A, PDE4A CSNK1D 1396/4885TP53 4455/4885MAPT 1159/4885

“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.