SCHEMBL25922698

SCHEMBL25922698

CN(CC(=O)NC(C)(C)C)c1nc(-c2cc(OCCN(C(=O)O)C(=O)O)ccn2)nc2c1CCC2

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.36
POLB P06746 1/20 0.36
KMT2A Q03164 1/20 0.36
HDAC1 Q13547 4/20 0.36
HDAC8 Q9BY41 4/20 0.36
HDAC6 Q9UBN7 4/20 0.36
PDE10A Q9Y233 4/20 0.35
SPR P35270 1/20 0.32
ADORA3 P0DMS8 2/20 0.32
SLC2A1 P11166 2/20 0.31
SLC2A3 P11169 2/20 0.31
PPARD Q03181 2/20 0.31
PPARA Q07869 2/20 0.31
ALDH1A1 P00352 1/20 0.30
SYK P43405 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
SCHEMBL23976139 0.93 HDAC1 (0.37) MEN1POLBKMT2AHDAC1HDAC8
SCHEMBL23976638 0.91 HDAC1 (0.36) MEN1POLBKMT2AHDAC1HDAC8
SCHEMBL30118766 0.90 SYK (0.38) MEN1POLBKMT2AHDAC1HDAC8
SCHEMBL23975777 0.90 SYK (0.38) MEN1POLBKMT2AHDAC1HDAC8
SCHEMBL26228707 0.90 HDAC1 (0.38) MEN1POLBKMT2AHDAC1HDAC8
SCHEMBL23976130 0.90 HDAC1 (0.35) MEN1POLBKMT2AHDAC1HDAC8
SCHEMBL30118866 0.90 HDAC1 (0.35) MEN1POLBKMT2AHDAC1HDAC8
SCHEMBL23975593 0.90 HDAC1 (0.37) MEN1POLBKMT2AHDAC1HDAC8
SCHEMBL30118823 0.90 HDAC1 (0.39) MEN1POLBKMT2AHDAC1HDAC8
SCHEMBL23975924 0.90 HDAC1 (0.39) MEN1POLBKMT2AHDAC1HDAC8

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-20230226074-A1 METHODS OF USE FOR PYRIMIDINES AS FERROPORTIN INHIBITORS GLOBAL BLOOD THERAPEUTICS INC (US) 2023-07-20 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-20230226074-A1 METHODS OF USE FOR PYRIMIDINES AS FERROPORTIN INHIBITORS SLC40A1, HAMP, SLC19A1 MEN1 2863/4885POLB 355/4885KMT2A 4375/4885

“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.