SCHEMBL10175704

SCHEMBL10175704

CC(Oc1ccc(N)cc1)C(=O)Nc1ccc(Cl)cc1

nearest known ligand 0.74

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 7/20 0.57
MEN1 O00255 6/20 0.57
POLB P06746 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.55
LMNA P02545 3/20 0.54
SCN3A Q9NY46 1/20 0.54
RXFP1 Q9HBX9 1/20 0.53
TDP1 Q9NUW8 1/20 0.52
KDM4E B2RXH2 1/20 0.52
ALDH1A1 P00352 1/20 0.52
GAA P10253 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
EPHX2 P34913 1/20 0.52
KLK7 P49862 1/20 0.52

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
SCHEMBL10175701 0.93 KMT2A (0.62) KMT2AMEN1POLBSMN1; SMN2LMNA
SCHEMBL10175698 0.87 KDM4E (0.67) KMT2AMEN1POLBSMN1; SMN2LMNA
SCHEMBL10175700 0.87 KMT2A (0.58) KMT2AMEN1POLBLMNASCN3A
SCHEMBL10175705 0.87 MEN1 (0.67) KMT2AMEN1LMNAALDH1A1GAA
SCHEMBL29768452 0.86 POLB (0.76) KMT2AMEN1POLBSMN1; SMN2LMNA
SCHEMBL10175711 0.86 LMNA (0.71) KMT2AMEN1POLBLMNASCN3A
SCHEMBL2610070 0.86 LMNA (0.66) KMT2AMEN1SMN1; SMN2LMNASCN3A
SCHEMBL2610073 0.85 KMT2A (0.72) KMT2AMEN1POLBRXFP1L3MBTL1
SCHEMBL10175988 0.85 KMT2A (0.72) KMT2AMEN1POLBRXFP1L3MBTL1
SCHEMBL10175696 0.85 KMT2A (0.63) KMT2AMEN1POLBLMNARXFP1

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-20150099781-A1 Compounds and Methods for Treating Mammalian Gastrointestinal Microbial Infections NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2015-04-09 US disclosed
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 (2 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 KMT2A 3016/4885MEN1 3561/4885POLB 2033/4885
US-20150099781-A1 Compounds and Methods for Treating Mammalian Gastrointestinal Microbial Infections IMPDH1, IMPDH2, IMPA1 KMT2A 3016/4885MEN1 3561/4885POLB 2033/4885

“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.