SCHEMBL13665692

SCHEMBL13665692

Cc1n[nH]c(C)c1Cc1cccc(C=O)c1

nearest known ligand 0.52

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.52
LMNA P02545 1/20 0.52
KMT2A Q03164 1/20 0.52
AR P10275 1/20 0.49
P2RX7 Q99572 1/20 0.43

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
SCHEMBL1774454 0.80 LMNA (0.66) MEN1LMNAKMT2AAR
Hydrochloric Acid SCHEMBL23068261 0.78 LMNA (0.64) MEN1LMNAKMT2AAR
SCHEMBL30644959 0.77 MAOA (0.45) MEN1LMNAKMT2A
SCHEMBL20546915 0.77 MAOA (0.45) MEN1LMNAKMT2A
SCHEMBL13653836 0.76 MEN1 (0.70) MEN1LMNAKMT2AAR
SCHEMBL6852425 0.74 ALDH1A1 (0.52)
SCHEMBL4234485 0.73 AR (0.72) MEN1LMNAKMT2AARP2RX7
SCHEMBL13313003 0.73 LMNA (0.66) MEN1LMNAKMT2AARP2RX7
SCHEMBL15653783 0.72 AKT2 (0.57) KMT2A
SCHEMBL20546828 0.72 MAOA (0.59)

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-20090270361-A1 Substituted pyrazole derivatives and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-10-29 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-20090270361-A1 Substituted pyrazole derivatives and use thereof CBR3, CBR1, NOX5 MEN1 2774/4885LMNA 4258/4885KMT2A 3457/4885

“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.