SCHEMBL10165837

SCHEMBL10165837

Cc1oc(-c2ccccc2)nc1CC(=O)C(C)C

nearest known ligand 0.74

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.74
HPGD P15428 1/20 0.56
PPARG P37231 13/20 0.54
PPARA Q07869 10/20 0.54
NPC1 O15118 1/20 0.52
RAB9A P51151 1/20 0.52
FFAR1 O14842 1/20 0.49
PPARD Q03181 1/20 0.49
TP53 P04637 1/20 0.48
HRH3 Q9Y5N1 1/20 0.48
TARBP2 Q15633 1/20 0.48

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
SCHEMBL24663754 0.87 KDM4E (0.56) KDM4EPPARATP53
SCHEMBL893027 0.85 KDM4E (1.00) KDM4EHPGDPPARGPPARANPC1
SCHEMBL24663755 0.84 KDM4E (0.53) KDM4EHPGDPPARGPPARA
SCHEMBL12379941 0.84 KDM4E (0.80) KDM4EHPGDPPARGPPARANPC1
SCHEMBL4936759 0.82 KDM4E (0.78) KDM4EHPGDPPARGPPARANPC1
SCHEMBL12883728 0.81 KDM4E (0.76) KDM4EHPGDPPARGPPARANPC1
SCHEMBL2930640 0.80 KDM4E (0.74) KDM4EHPGDPPARGPPARAFFAR1
SCHEMBL8573755 0.80 KDM4E (0.74) KDM4EHPGDPPARGPPARANPC1
SCHEMBL12868351 0.80 KDM4E (0.74) KDM4EHPGDPPARGPPARAFFAR1
SCHEMBL14260722 0.80 KDM4E (0.74) KDM4EHPGDPPARGPPARAFFAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120035194-A1 SUBSTITUTED 2-AMINO-FUSED HETEROCYCLIC COMPOUNDS PFIZER INC. (US) 2012-02-09 US disclosed
US-7998978-B2 Substituted 2-amino-fused heterocyclic compounds PFIZER INC. (US) 2011-08-16 US disclosed
US-20100056506-A1 SUBSTITUTED 2-AMINO-FUSED HETEROCYCLIC COMPOUNDS PFIZER PRODUCTS INC. (US) 2010-03-04 US disclosed
US-20100056506-A1 SUBSTITUTED 2-AMINO-FUSED HETEROCYCLIC COMPOUNDS PFIZER PRODUCTS INC. (US) 2010-03-04 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 (2 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-20120035194-A1 SUBSTITUTED 2-AMINO-FUSED HETEROCYCLIC COMPOUNDS MAPK1, SLC5A1, ATF1 KDM4E 2041/4885HPGD 2227/4885PPARG 264/4885
US-20100056506-A1 SUBSTITUTED 2-AMINO-FUSED HETEROCYCLIC COMPOUNDS MAPK1, SLC5A1, ATF1 KDM4E 2041/4885HPGD 2227/4885PPARG 264/4885

“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.