SCHEMBL6375770

SCHEMBL6375770

COC(=O)C(c1ccccc1)N1C(=O)CN=Cc2ccccc21

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.45
MEN1 O00255 1/20 0.45
ALDH1A1 P00352 1/20 0.45
LMNA P02545 1/20 0.45
OPRL1 P41146 2/20 0.41
OPRM1 P35372 1/20 0.41
OPRK1 P41145 1/20 0.41
MAPT P10636 1/20 0.36
P2RX4 Q99571 1/20 0.36
NPY2R P49146 6/20 0.35
NR3C2 P08235 1/20 0.34
CRHBP P24387 1/20 0.33
CRHR2 Q13324 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C19 P33261 1/20 0.33
ELANE P08246 2/20 0.32

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
SCHEMBL6375766 0.79 KMT2A (0.45) KMT2AMEN1ALDH1A1LMNAOPRL1
SCHEMBL5349092 0.76 GABRA1 (0.54) KMT2AMEN1ALDH1A1LMNAOPRK1
SCHEMBL27528615 0.73 KMT2A (0.42) KMT2AMEN1ALDH1A1LMNAOPRL1
SCHEMBL11275312 0.69 KMT2A (0.50) KMT2AMEN1ALDH1A1LMNAOPRL1
SCHEMBL23886508 0.67 CYP3A4 (0.60) KMT2AMEN1ALDH1A1LMNAOPRL1
SCHEMBL6785068 0.67 GABRA1 (0.46) ALDH1A1LMNAOPRL1OPRK1MAPT
SCHEMBL10862008 0.67 KMT2A (0.71) KMT2AMEN1ALDH1A1LMNAOPRL1
SCHEMBL3195392 0.65 KMT2A (0.68) KMT2AMEN1ALDH1A1LMNAOPRL1
SCHEMBL7657250 0.65 LMNA (0.94) KMT2AMEN1ALDH1A1LMNAOPRL1
SCHEMBL3195397 0.65 KMT2A (0.68) KMT2AMEN1ALDH1A1LMNAOPRL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050272666-A1 Cycloalkyl, lactam, lactone and related compounds, pharmaceutical compositions comprising same, and methods for inhibiting beta-amyloid peptide release and/or its synthesis by use of such compounds WU JING 2005-12-08 US disclosed
US-6632811-B2 Administering cycloalkyl, lactam, lactone compounds for for inhibiting beta -amyloid peptide release and/or its synthesis in a cell ATHENA NEUROSCIENCES, INC. 2003-10-14 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-20050272666-A1 Cycloalkyl, lactam, lactone and related compounds, pharmaceutical compositions comprising same, and methods for inhibiting beta-amyloid peptide release and/or its synthesis by use of such compounds BACE1, APP, BACE2 KMT2A 4749/4885MEN1 1035/4885ALDH1A1 3897/4885

“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.