SCHEMBL2575673

SCHEMBL2575673

O=C(Cc1ccc(-c2ccccc2)cc1)Nc1cnc(-n2cccn2)nc1O

nearest known ligand 0.64

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
EGLN1 Q9GZT9 3/20 0.64
KMT2A Q03164 7/20 0.47
MEN1 O00255 6/20 0.47
RAB9A P51151 2/20 0.47
NPC1 O15118 2/20 0.47
SLC6A2 P23975 1/20 0.47
SLC6A3 Q01959 1/20 0.47
WNT3A P56704 5/20 0.44
TMIGD3 P0DMS9 1/20 0.43
RET P07949 1/20 0.43
LMNA P02545 1/20 0.42
PKM P14618 1/20 0.42
TP53 P04637 1/20 0.42

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
SCHEMBL2568896 0.88 EGLN1 (0.50) EGLN1KMT2AMEN1RAB9ANPC1
SCHEMBL2566665 0.88 EGLN1 (0.49) EGLN1RAB9ANPC1WNT3ATMIGD3
SCHEMBL2568106 0.87 EGLN1 (0.67) EGLN1KMT2AMEN1
SCHEMBL2575724 0.86 TP53 (0.50) EGLN1KMT2AMEN1RAB9ANPC1
SCHEMBL2575470 0.86 EGLN1 (0.50) EGLN1RETLMNA
SCHEMBL2561739 0.84 EGLN1 (0.47) EGLN1KMT2AMEN1RAB9ANPC1
SCHEMBL2564568 0.83 MEN1 (0.47) EGLN1KMT2AMEN1RAB9ANPC1
SCHEMBL2567761 0.82 EGLN1 (0.48) EGLN1KMT2AMEN1LMNATP53
SCHEMBL2563451 0.81 MEN1 (0.49) EGLN1KMT2AMEN1RAB9ANPC1
SCHEMBL2560126 0.81 MEN1 (0.46) EGLN1KMT2AMEN1

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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2560655-B1 SUBSTITUTED PYRIMIDINES MERCK SHARP & DOHME (US) 2016-08-24 EP claimed
US-9006433-B2 Substituted pyrimidines MERCK SHARP & DOHME CORP. (US) 2015-04-14 US claimed
US-20130018053-A1 SUBSTITUTED PYRIMIDINES MERCK SHARP & DOHME LLC 2013-01-17 US claimed
WO-2011130908-A1 SUBSTITUTED PYRIMIDINES MERCK SHARP & DOHME CORP. (US) 2011-10-27 WO claimed
EP-2560655-B1 SUBSTITUTED PYRIMIDINES MERCK SHARP & DOHME (US) 2016-08-24 EP disclosed
US-9006433-B2 Substituted pyrimidines MERCK SHARP & DOHME CORP. (US) 2015-04-14 US disclosed
US-9006433-B2 Substituted pyrimidines MERCK SHARP & DOHME CORP. (US) 2015-04-14 US disclosed
US-20130018053-A1 SUBSTITUTED PYRIMIDINES MERCK SHARP & DOHME LLC 2013-01-17 US disclosed
US-20130018053-A1 SUBSTITUTED PYRIMIDINES MERCK SHARP & DOHME LLC 2013-01-17 US disclosed
WO-2011130908-A1 SUBSTITUTED PYRIMIDINES MERCK SHARP & DOHME CORP. (US) 2011-10-27 WO disclosed
WO-2011130908-A1 SUBSTITUTED PYRIMIDINES MERCK SHARP & DOHME CORP. (US) 2011-10-27 WO 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-20130018053-A1 SUBSTITUTED PYRIMIDINES HIF1AN, HIF1A, EGLN3 EGLN1 7/4885KMT2A 408/4885MEN1 4437/4885

“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.