SCHEMBL6035571

SCHEMBL6035571

CC(=O)c1ccc(-n2cc(CCCO)c(C(C)C)n2)nc1

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KCNJ1 P48048 1/20 0.44
EGLN1 Q9GZT9 2/20 0.34
LMNA P02545 3/20 0.34
HRH3 Q9Y5N1 1/20 0.34
KMT2A Q03164 1/20 0.32
MAPT P10636 1/20 0.31
GRIA1 P42261 2/20 0.31
AOC3 Q16853 1/20 0.30
HSP90AA1 P07900 1/20 0.30
HSP90AB1 P08238 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
SCHEMBL6036231 0.83 PANK3 (0.32) EGLN1GRIA1
SCHEMBL6036147 0.82 CYP11B1 (0.34) MAPTGRIA1
SCHEMBL6035787 0.82 CYP11B1 (0.34) EGLN1KMT2AMAPTGRIA1
SCHEMBL6034668 0.82 CYP11B1 (0.34) HRH3GRIA1
SCHEMBL6035601 0.80 MAPT (0.39) LMNAKMT2AMAPT
SCHEMBL6034887 0.80 CNR1 (0.37) LMNAHRH3MAPT
SCHEMBL6035090 0.80 KDM4E (0.39) EGLN1
SCHEMBL6216219 0.79 LMNA (0.36) KCNJ1EGLN1LMNAKMT2AMAPT
SCHEMBL6035846 0.77 PPARG (0.44) KCNJ1EGLN1LMNAKMT2AMAPT
SCHEMBL6035102 0.76 CNR1 (0.37) LMNAHRH3MAPT

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-20060148858-A1 1, 2-Azole derivatives with hypoglycemic and hypolipidemic activity TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2006-07-06 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-20060148858-A1 1, 2-Azole derivatives with hypoglycemic and hypolipidemic activity GPR119, SLC5A1, CYP4B1 KCNJ1 737/4885EGLN1 455/4885LMNA 1816/4885

“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.