SCHEMBL5464280

SCHEMBL5464280

N#Cc1ccc2c(c1)CN(c1cc(S(=O)(=O)N3CCCc4ccccc43)ccc1Cl)C(=O)N2

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.51
MEN1 O00255 2/20 0.51
GNRHR P30968 4/20 0.49
NR3C1 P04150 1/20 0.48
AR P10275 1/20 0.48
ALDH1A1 P00352 2/20 0.46
MAPK1 P28482 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
TSHR P16473 1/20 0.45
LMNA P02545 2/20 0.45
TP53 P04637 1/20 0.45
ATM Q13315 1/20 0.44
CYP11B1 P15538 1/20 0.43
CYP11B2 P19099 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
SCHEMBL5473062 0.93 KMT2A (0.51) KMT2AMEN1GNRHRNR3C1AR
SCHEMBL5467352 0.88 KMT2A (0.59) KMT2AMEN1GNRHRALDH1A1MAPK1
SCHEMBL5461670 0.87 GNRHR (0.53) KMT2AMEN1GNRHRALDH1A1MAPK1
SCHEMBL5468959 0.87 KMT2A (0.53) KMT2AMEN1GNRHRALDH1A1MAPK1
SCHEMBL5461096 0.85 KMT2A (0.61) KMT2AMEN1GNRHRALDH1A1MAPK1
SCHEMBL5471890 0.85 KMT2A (0.54) KMT2AMEN1GNRHRALDH1A1MAPK1
SCHEMBL5474826 0.84 KMT2A (0.53) KMT2AMEN1GNRHRALDH1A1MAPK1
SCHEMBL5460881 0.83 NR3C1 (0.49) KMT2AMEN1NR3C1ARALDH1A1
SCHEMBL5470980 0.83 KMT2A (0.52) KMT2AMEN1GNRHRALDH1A1MAPK1
SCHEMBL5470943 0.82 GNRHR (0.55) KMT2AMEN1GNRHRALDH1A1LMNA

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-20070010537-A1 Fused pyramidine derivative and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-01-11 US disclosed
US-20070010537-A1 Fused pyramidine derivative and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-01-11 US disclosed
EP-1657238-A1 FUSED PYRIMIDINE DERIVATIVE AND USE THEREOF Takeda Pharmaceutical Company Limited (JP) 2006-05-17 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-20070010537-A1 Fused pyramidine derivative and use thereof NR5A1, GNRHR, RXFP3 KMT2A 1132/4885MEN1 1223/4885GNRHR 2/4885

“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.