SCHEMBL12295223

SCHEMBL12295223

Cc1nc2ccccn2c1C(=O)NCc1ccc(C(=O)O)cc1

nearest known ligand 0.84

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.74
LMNA P02545 3/20 0.74
HTT P42858 2/20 0.74
SMN1; SMN2 Q16637 2/20 0.74
PKM P14618 1/20 0.74
NPSR1 Q6W5P4 1/20 0.66
HSD17B10 Q99714 1/20 0.66
L3MBTL1 Q9Y468 1/20 0.64
ALDH1A1 P00352 2/20 0.62
KMT2A Q03164 2/20 0.62
GAA P10253 1/20 0.62
POLB P06746 1/20 0.56
MAPK1 P28482 1/20 0.54
GLA P06280 1/20 0.53
NPC1 O15118 1/20 0.53
TP53 P04637 1/20 0.53
RAB9A P51151 1/20 0.53

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
SCHEMBL12295463 0.92 KDM4E (0.78) KDM4ELMNAHTTSMN1; SMN2PKM
SCHEMBL12294732 0.89 KDM4E (0.76) KDM4ELMNAHTTSMN1; SMN2PKM
SCHEMBL12295461 0.89 KDM4E (0.78) KDM4ELMNAHTTSMN1; SMN2PKM
SCHEMBL12294919 0.87 KDM4E (0.76) KDM4ELMNAHTTSMN1; SMN2PKM
SCHEMBL12294733 0.86 KDM4E (0.82) KDM4ELMNAHTTSMN1; SMN2PKM
SCHEMBL12295464 0.86 KDM4E (0.73) KDM4ELMNAHTTSMN1; SMN2PKM
SCHEMBL12295458 0.85 KDM4E (1.00) KDM4ELMNAHTTSMN1; SMN2PKM
SCHEMBL23655634 0.81 LMNA (0.50) KDM4ELMNAHTTSMN1; SMN2PKM
SCHEMBL12294568 0.81 KDM4E (0.66) KDM4ELMNAHTTSMN1; SMN2PKM
SCHEMBL2400067 0.80 KDM4E (0.71) KDM4ELMNAHTTSMN1; SMN2PKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9029389-B2 Anti-inflammation compounds INSTITUT PASTEUR KOREA (KR) 2015-05-12 US claimed
US-8865734-B2 Anti-infective compounds INSTITUT PASTEUR KOREA (KR) 2014-10-21 US claimed
EP-2547678-B1 ANTI-INFECTIVE COMPOUNDS PASTEUR INSTITUT KOREA (KR) 2016-03-16 EP disclosed
EP-2547678-B1 ANTI-INFECTIVE COMPOUNDS PASTEUR INSTITUT KOREA (KR) 2016-03-16 EP disclosed
US-9029389-B2 Anti-inflammation compounds INSTITUT PASTEUR KOREA (KR) 2015-05-12 US disclosed
US-9029389-B2 Anti-inflammation compounds INSTITUT PASTEUR KOREA (KR) 2015-05-12 US disclosed
US-8865734-B2 Anti-infective compounds INSTITUT PASTEUR KOREA (KR) 2014-10-21 US disclosed
US-8865734-B2 Anti-infective compounds INSTITUT PASTEUR KOREA (KR) 2014-10-21 US disclosed
US-20140155387-A1 Anti-Inflammation Compounds QURIENT, CO. LTD. (KR) 2014-06-05 US disclosed
US-20140155387-A1 Anti-Inflammation Compounds QURIENT, CO. LTD. (KR) 2014-06-05 US disclosed
US-20130065884-A1 Anti-Infective Compounds INSTITUT PASTEUR KOREA (KR) 2013-03-14 US disclosed
US-20130065884-A1 Anti-Infective Compounds INSTITUT PASTEUR KOREA (KR) 2013-03-14 US disclosed
WO-2012143796-A2 ANTI-INFLAMMATION COMPOUNDS INSTITUT PASTEUR KOREA (KR) 2012-10-26 WO disclosed
WO-2011113606-A1 ANTI-INFECTIVE COMPOUNDS INSTITUT PASTEUR KOREA (KR) 2011-09-22 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-20130065884-A1 Anti-Infective Compounds RABGGTB, ELANE, SERPINB1 KDM4E 4439/4885LMNA 4132/4885HTT 3860/4885
US-20140155387-A1 Anti-Inflammation Compounds NR0B1, NR0B2, NR5A2 KDM4E 2886/4885LMNA 3721/4885HTT 4491/4885

“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.