SCHEMBL20533573

SCHEMBL20533573

CCOC(=O)N1CCN(c2nc(N)n3nc(C)c(-c4ccc(OC)c(OC)c4)c3n2)CC1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
CRHBP P24387 1/20 0.49
CRHR2 Q13324 1/20 0.49
MAPT P10636 6/20 0.49
LMNA P02545 3/20 0.49
HSD17B10 Q99714 2/20 0.49
CASP1 P29466 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
ALDH1A1 P00352 3/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
TP53 P04637 1/20 0.47
GAA P10253 1/20 0.47
HPGD P15428 1/20 0.47
TSHR P16473 1/20 0.47
MAPK1 P28482 1/20 0.47
GAK O14976 1/20 0.47
ACHE P22303 2/20 0.46
SMPD3 Q9NY59 1/20 0.46
POLB P06746 2/20 0.46

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
SCHEMBL20533765 0.86 MAPT (0.51) MEN1KMT2ACRHBPCRHR2MAPT
SCHEMBL20533770 0.86 MAPT (0.55) MEN1KMT2ACRHBPCRHR2MAPT
SCHEMBL20533902 0.85 KMT2A (0.56) MEN1KMT2ACRHBPCRHR2MAPT
SCHEMBL20533926 0.84 MAPT (0.54) MEN1KMT2ACRHBPCRHR2MAPT
SCHEMBL20533944 0.84 KMT2A (0.69) MEN1KMT2ACRHBPCRHR2MAPT
SCHEMBL20534225 0.82 KMT2A (0.53) MEN1KMT2ACRHBPCRHR2MAPT
SCHEMBL20534226 0.82 PI4KB (0.55) MEN1KMT2ACRHBPCRHR2MAPT
SCHEMBL20533949 0.80 MAPT (0.73) MEN1KMT2ACRHBPCRHR2MAPT
SCHEMBL20534232 0.79 MAPT (0.54) MEN1KMT2ACRHBPCRHR2MAPT
SCHEMBL9401018 0.74 GAK (0.66) MEN1KMT2AMAPTLMNAALDH1A1

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 MEN1 3280/4885KMT2A 2326/4885CRHBP 3837/4885

“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.