SCHEMBL10176511

SCHEMBL10176511

Cc1ccc(NC(=O)COc2cccc3ccccc23)cc1

nearest known ligand 0.73

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 6/20 0.73
KMT2A Q03164 6/20 0.73
ALDH1A1 P00352 4/20 0.64
KDM4E B2RXH2 3/20 0.64
HPGD P15428 2/20 0.64
LMNA P02545 1/20 0.64
SMN1; SMN2 Q16637 1/20 0.64
DAPK1 P53355 1/20 0.64
PIM3 Q86V86 1/20 0.64
OGG1 O15527 1/20 0.62
TP53 P04637 1/20 0.60
POLB P06746 1/20 0.60
NOTUM Q6P988 1/20 0.58
MAPT P10636 2/20 0.57
HTT P42858 1/20 0.56
TDP1 Q9NUW8 2/20 0.56
GBA1 P04062 1/20 0.55

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
SCHEMBL12003962 0.89 MEN1 (0.80) MEN1KMT2AALDH1A1KDM4EHPGD
SCHEMBL10176509 0.88 MEN1 (0.74) MEN1KMT2AALDH1A1KDM4EHPGD
SCHEMBL9041433 0.87 KMT2A (0.77) MEN1KMT2AALDH1A1KDM4EHPGD
SCHEMBL10176505 0.86 MEN1 (0.73) MEN1KMT2AALDH1A1KDM4EHPGD
SCHEMBL409058 0.86 MEN1 (0.73) MEN1KMT2AALDH1A1KDM4EHPGD
SCHEMBL30776644 0.84 MEN1 (1.00) MEN1KMT2AALDH1A1KDM4EHPGD
SCHEMBL10176504 0.83 KMT2A (0.68) MEN1KMT2AALDH1A1KDM4EHPGD
SCHEMBL16626998 0.83 MEN1 (0.68) MEN1KMT2AALDH1A1KDM4EHPGD
SCHEMBL26343146 0.81 DAPK1 (0.64) MEN1KMT2AALDH1A1KDM4EHPGD
SCHEMBL6846901 0.80 OGG1 (0.72) MEN1KMT2AALDH1A1KDM4EHPGD

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-8969342-B2 Compounds and methods for treating mammalian gastrointestinal microbial infections BRANDEIS UNIVERSITY (US) 2015-03-03 US disclosed
US-20120101096-A1 Compounds and Methods for Treating Mammalian Gastrointestinal Microbial Infections University of Georgia Foundation, Inc. (US) 2012-04-26 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-20120101096-A1 Compounds and Methods for Treating Mammalian Gastrointestinal Microbial Infections IMPDH1, IMPDH2, IMPA1 MEN1 3561/4885KMT2A 3016/4885ALDH1A1 45/4885

“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.