SCHEMBL5380927

SCHEMBL5380927

Nc1ccc(NC(=O)c2ccc(F)cc2O)c(OCc2ccccc2)c1

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.50
TDP1 Q9NUW8 1/20 0.50
KMT2A Q03164 2/20 0.48
RAB9A P51151 1/20 0.48
LRRK2 Q5S007 2/20 0.48
GAA P10253 1/20 0.46
SGMS2 Q8NHU3 2/20 0.46
PPIA P62937 1/20 0.46
BRD4 O60885 5/20 0.45
LMNA P02545 1/20 0.45
MAPT P10636 1/20 0.45
NPC1 O15118 1/20 0.45
MEN1 O00255 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
SCHEMBL14428106 0.82 MET (0.55) L3MBTL1TDP1RAB9AGAASGMS2
SCHEMBL5384622 0.79 LRRK2 (0.47) L3MBTL1TDP1KMT2ARAB9ALRRK2
SCHEMBL5391360 0.78 MET (0.53) L3MBTL1TDP1RAB9AGAASGMS2
SCHEMBL5387944 0.77 CNR2 (0.52) L3MBTL1TDP1LRRK2GAASGMS2
SCHEMBL5399487 0.77 BRD4 (0.70) KMT2ABRD4MEN1
SCHEMBL5375951 0.77 EPHX2 (0.50) L3MBTL1TDP1KMT2ARAB9ALRRK2
SCHEMBL8926580 0.74 BRD4 (0.74) KMT2ARAB9AGAAPPIABRD4
SCHEMBL2718364 0.74 TAS1R3 (0.59) KMT2ARAB9AGAAMAPTNPC1
SCHEMBL11687092 0.74 TDP1 (0.64) L3MBTL1TDP1KMT2ARAB9AGAA
SCHEMBL1741575 0.73 FFAR4 (0.67) L3MBTL1KMT2ARAB9ALMNAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070197533-A1 Antibacterial 3,5-diaminopiperidine-substituted aromatic and heteroaromatic compounds ANADYS PHARMACEUTICALS, INC. (US) 2007-08-23 US disclosed
US-20070197533-A1 Antibacterial 3,5-diaminopiperidine-substituted aromatic and heteroaromatic compounds ANADYS PHARMACEUTICALS, INC. (US) 2007-08-23 US disclosed
US-20070197533-A1 Antibacterial 3,5-diaminopiperidine-substituted aromatic and heteroaromatic compounds ANADYS PHARMACEUTICALS, INC. (US) 2007-08-23 US disclosed
US-7223759-B2 Antibacterial 3,5-diaminopiperidine-substituted aromatic and heteroaromatic compounds ANADYS PHARMACEUTICALS, INC. (US) 2007-05-29 US disclosed
US-7223759-B2 Antibacterial 3,5-diaminopiperidine-substituted aromatic and heteroaromatic compounds ANADYS PHARMACEUTICALS, INC. (US) 2007-05-29 US disclosed
US-7223759-B2 Antibacterial 3,5-diaminopiperidine-substituted aromatic and heteroaromatic compounds ANADYS PHARMACEUTICALS, INC. (US) 2007-05-29 US disclosed
US-20050239827-A1 Antibacterial 3,5-diaminopiperidine-substituted aromatic and heteroaromatic compouds ANADYS PHARMACEUTICALS, INC. 2005-10-27 US disclosed
WO-2005028467-A1 ANTIBACTERIAL 3,5-DIAMINOPIPERIDINE-SUBSTITUTE AROMATIC AND HETEROAROMATIC COMPOUNDS ANADYS PHARMACEUTICALS, INC. (US) 2005-03-31 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 (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-20070197533-A1 Antibacterial 3,5-diaminopiperidine-substituted aromatic and heteroaromatic compounds DDC, DPP3, AMPD3 L3MBTL1 2152/4885TDP1 2209/4885KMT2A 3738/4885
US-20050239827-A1 Antibacterial 3,5-diaminopiperidine-substituted aromatic and heteroaromatic compouds AMPD3, AAAS, PEPD L3MBTL1 2101/4885TDP1 1488/4885KMT2A 3545/4885

“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.