SCHEMBL2161663

SCHEMBL2161663

Cc1c(C)n(Cc2ccc(Cl)cc2)c2ccc(C(=O)NCCCN3CCCCC3)cc12

nearest known ligand 0.83

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.83
MEN1 O00255 2/20 0.83
MAPT P10636 4/20 0.76
CACNA1G O43497 6/20 0.62
HTR3A P46098 1/20 0.62
TP53 P04637 1/20 0.61
RAD52 P43351 1/20 0.60

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
SCHEMBL2161670 1.00 KMT2A (0.83) KMT2AMEN1MAPTCACNA1GHTR3A
SCHEMBL2162550 0.99 KMT2A (0.85) KMT2AMEN1MAPTCACNA1GHTR3A
SCHEMBL2161686 0.94 KMT2A (0.75) KMT2AMEN1MAPTCACNA1GHTR3A
SCHEMBL2161496 0.93 KMT2A (0.83) KMT2AMEN1MAPTCACNA1GTP53
SCHEMBL4701497 0.93 KMT2A (0.83) KMT2AMEN1MAPTTP53RAD52
SCHEMBL2171584 0.92 KMT2A (0.82) KMT2AMEN1MAPTCACNA1GTP53
SCHEMBL2161642 0.92 KMT2A (0.83) KMT2AMEN1MAPTTP53RAD52
SCHEMBL2161514 0.91 KMT2A (1.00) KMT2AMEN1MAPTHTR3ATP53
SCHEMBL2162334 0.91 KMT2A (0.74) KMT2AMEN1MAPTTP53RAD52
SCHEMBL2162127 0.91 KMT2A (0.84) KMT2AMEN1MAPTTP53RAD52

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.