SCHEMBL20534207

SCHEMBL20534207

COc1ccc(-c2c(C)nn3c(NCc4ccnc(C)c4)cc(Cl)nc23)cc1OC

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PI4KB Q9UBF8 12/20 0.58
MAPT P10636 6/20 0.54
KDM4E B2RXH2 3/20 0.54
ALDH1A1 P00352 3/20 0.54
MEN1 O00255 2/20 0.54
HPGD P15428 2/20 0.54
KMT2A Q03164 2/20 0.54
NPSR1 Q6W5P4 2/20 0.54
ATM Q13315 1/20 0.49
CRHR1 P34998 1/20 0.48
LMNA P02545 1/20 0.47
TP53 P04637 1/20 0.47
MAPK1 P28482 1/20 0.47
RAB9A P51151 1/20 0.47
TDP1 Q9NUW8 1/20 0.47

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
SCHEMBL20533892 0.86 MAPT (0.57) PI4KBMAPTKDM4EALDH1A1MEN1
SCHEMBL16935106 0.82 PI4KB (0.61) PI4KBMAPTKDM4EALDH1A1MEN1
SCHEMBL16935053 0.81 MAPT (0.76) PI4KBMAPTKDM4EALDH1A1MEN1
SCHEMBL29715008 0.81 MAPT (0.76) PI4KBMAPTKDM4EALDH1A1MEN1
SCHEMBL20533943 0.81 PI4KB (0.48) PI4KBMAPTALDH1A1MEN1HPGD
SCHEMBL20533955 0.80 PI4KB (0.52) PI4KBMAPTKDM4EALDH1A1MEN1
SCHEMBL20533937 0.80 CRHR1 (0.56) PI4KBMAPTKDM4EALDH1A1MEN1
SCHEMBL20533722 0.79 PI4KB (0.62) PI4KBMAPTKDM4EALDH1A1MEN1
SCHEMBL16935032 0.79 MAPT (0.65) PI4KBMAPTKDM4EALDH1A1MEN1
SCHEMBL16935081 0.79 PI4KB (0.74) PI4KBMAPTKDM4EALDH1A1MEN1

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-20180298009-A1 Fused Pyrazole Derivatives As Kinase Inhibitors UCB BIOPHARMA SPRL (BE) 2018-10-18 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 (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-20180298009-A1 Fused Pyrazole Derivatives As Kinase Inhibitors PI4KA, PI4K2B, PI4KB PI4KB 3/4885MAPT 2367/4885KDM4E 1098/4885

“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.