SCHEMBL2926767

SCHEMBL2926767

COC(=O)CC(c1ccccc1)N1Cc2ccccc2C1=O

nearest known ligand 0.66

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 6/20 0.66
KMT2A Q03164 6/20 0.66
MAPT P10636 4/20 0.58
TP53 P04637 3/20 0.58
POLB P06746 1/20 0.58
KDM4E B2RXH2 1/20 0.56
ALDH1A1 P00352 1/20 0.56
ALOX15 P16050 1/20 0.56
TSHR P16473 1/20 0.56
XIAP P98170 1/20 0.56
HKDC1 Q2TB90 1/20 0.56
HSD17B10 Q99714 1/20 0.56
TDP1 Q9NUW8 1/20 0.56
L3MBTL1 Q9Y468 1/20 0.56
THRB P10828 1/20 0.56
RAB9A P51151 1/20 0.54

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
SCHEMBL825571 0.85 MEN1 (0.83) MEN1KMT2AMAPTTP53POLB
SCHEMBL7885470 0.85 TNF (0.69) MEN1KMT2AMAPTTP53
SCHEMBL825515 0.83 MEN1 (0.71) MEN1KMT2AMAPTTP53POLB
SCHEMBL4441275 0.82 KMT2A (0.73) MEN1KMT2AMAPTTP53POLB
SCHEMBL825658 0.81 PDE4A (0.72) MEN1KMT2AMAPTTP53
SCHEMBL23706096 0.80 MEN1 (1.00) MEN1KMT2AMAPTKDM4EALDH1A1
SCHEMBL825643 0.80 PDE4A (0.61) MEN1KMT2AMAPTTP53
SCHEMBL825856 0.79 PDE4A (0.60) MEN1KMT2AMAPTTP53
SCHEMBL4445007 0.79 MEN1 (0.72) MEN1KMT2AMAPTTP53POLB
SCHEMBL6693021 0.79 TNF (0.70) ALDH1A1HSD17B10L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8431602-B2 Beta-amino acid derivatives for treatment of diabetes MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2013-04-30 US disclosed
EP-2231640-B1 BETA-AMINO ACID DERIVATIVES FOR TREATMENT OF DIABETES MERCK PATENT GMBH (DE) 2012-06-06 EP disclosed
US-20100331346-A1 BETA-AMINO ACID DERIVATIVES FOR TREATMENT OF DIABETES MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2010-12-30 US disclosed
EP-2231640-A1 BETA-AMINO ACID DERIVATIVES FOR TREATMENT OF DIABETES Merck Patent GmbH (DE) 2010-09-29 EP disclosed
WO-2009092432-A1 BETA-AMINO ACID DERIVATIVES FOR TREATMENT OF DIABETES MERCK PATENT GMBH (DE) 2009-07-30 WO 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-20100331346-A1 BETA-AMINO ACID DERIVATIVES FOR TREATMENT OF DIABETES GPR119, GLS, GCKR MEN1 3909/4885KMT2A 3191/4885MAPT 3056/4885

“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.