SCHEMBL2162127

SCHEMBL2162127

Cc1c(C)n(Cc2ccccc2)c2ccc(C(=O)NCCCN3CCCC3)cc12

nearest known ligand 0.84

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.84
MEN1 O00255 2/20 0.77
MAPT P10636 3/20 0.75
THRB P10828 1/20 0.66
PPARG P37231 1/20 0.62
RAD52 P43351 1/20 0.62
TP53 P04637 1/20 0.59

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
SCHEMBL2161642 0.99 KMT2A (0.83) KMT2AMEN1MAPTTHRBPPARG
SCHEMBL2161696 0.94 KMT2A (0.84) KMT2AMEN1MAPTTHRBPPARG
SCHEMBL2161520 0.93 KMT2A (0.83) KMT2AMEN1MAPTTHRBPPARG
SCHEMBL2161707 0.92 KMT2A (1.00) KMT2AMEN1MAPTTHRBPPARG
SCHEMBL2162550 0.91 KMT2A (0.85) KMT2AMEN1MAPTRAD52TP53
SCHEMBL2161663 0.91 KMT2A (0.83) KMT2AMEN1MAPTRAD52TP53
SCHEMBL2162334 0.91 KMT2A (0.74) KMT2AMEN1MAPTPPARGRAD52
SCHEMBL2161670 0.91 KMT2A (0.83) KMT2AMEN1MAPTRAD52TP53
SCHEMBL2161708 0.87 KMT2A (0.74) KMT2AMEN1MAPTTHRBRAD52
SCHEMBL2162618 0.87 KMT2A (0.73) KMT2AMEN1MAPTTHRBPPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7985764-B2 Amide derivative or salt thereof ASTELLAS PHARMA INC. (JP) 2011-07-26 US disclosed
US-20090062363-A1 AMIDE DERIVATIVE OR SALT THEREOF ASTELLAS PHARMA INC. (JP) 2009-03-05 US disclosed
EP-1988076-A1 AMIDE DERIVATIVE OR SALT THEREOF Astellas Pharma Inc. (JP) 2008-11-05 EP 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-20090062363-A1 AMIDE DERIVATIVE OR SALT THEREOF HTR7, HTR2B, NPSR1 KMT2A 2331/4885MEN1 3828/4885MAPT 4469/4885

“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.