SCHEMBL6744858

SCHEMBL6744858

COc1cc(N=Cc2cnc(SC)nc2C(C)N)c(Cl)c(OC)c1

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PDCD1 Q15116 2/20 0.34
CD274 Q9NZQ7 2/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
CYP1B1 Q16678 1/20 0.32
GAA P10253 1/20 0.31
MAPT P10636 1/20 0.31
PKM P14618 1/20 0.31
RAB9A P51151 1/20 0.31
FGFR4 P22455 1/20 0.30

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
SCHEMBL3970550 0.83 CYP1A2 (0.35) MEN1KMT2ACYP1B1GAAMAPT
SCHEMBL3970556 0.80 PGK1 (0.39) MEN1KMT2AGAAMAPTPKM
SCHEMBL3970549 0.80 PGK1 (0.39) MEN1KMT2AGAAMAPTPKM
SCHEMBL6206210 0.78 KDM4E (0.31) MEN1KMT2A
SCHEMBL3971037 0.66 FGFR4 (0.38) MEN1KMT2AMAPTRAB9AFGFR4
SCHEMBL3971035 0.66 FGFR4 (0.38) MEN1KMT2AMAPTRAB9AFGFR4
SCHEMBL3969852 0.65 FGFR4 (0.34) MEN1KMT2AMAPTRAB9AFGFR4
SCHEMBL3970879 0.63 HTT (0.38) MEN1KMT2AMAPT
SCHEMBL23328260 0.62 MEN1 (0.35) MEN1KMT2AFGFR4
SCHEMBL21783949 0.62 FGFR1 (0.47) MEN1KMT2AFGFR4

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-20040044012-A1 Bicyclic pyrimidines and bicyclic 3,4-dihydropyrimidines as inhibitors of cellular proliferation DOBRUSIN ELLEN MYRA (US) 2004-03-04 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-20040044012-A1 Bicyclic pyrimidines and bicyclic 3,4-dihydropyrimidines as inhibitors of cellular proliferation CCNI, CCNH, CCNA1 PDCD1 981/4885CD274 1518/4885MEN1 4287/4885

“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.