SCHEMBL4310355

SCHEMBL4310355

NC(=O)OC(Cn1cnnn1)c1ccc2c(c1)OCO2

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.49
MAPK1 P28482 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
KMT2A Q03164 3/20 0.41
MEN1 O00255 2/20 0.41
IGF2BP1 Q9NZI8 2/20 0.40
FAAH O00519 1/20 0.39
MGLL Q99685 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
NPSR1 Q6W5P4 1/20 0.39
ULK1 O75385 1/20 0.38
EDNRA P25101 2/20 0.38
MAPK9 P45984 1/20 0.37
OGA O60502 4/20 0.36
ALDH1A1 P00352 1/20 0.36
GAA P10253 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C9 P11712 1/20 0.36

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
SCHEMBL4309086 0.80 DPP4 (0.36) ALDH1A1
SCHEMBL13667426 0.80 MAPK1 (0.45) KDM4EMAPK1KMT2AMEN1
SCHEMBL4321585 0.79 TNIK (0.40) KDM4EKMT2ACYP3A4CYP2D6
SCHEMBL4304627 0.78 HMOX1 (0.43) KDM4EKMT2AMEN1SMN1; SMN2NPSR1
SCHEMBL4306543 0.75 NPC1 (0.38) KMT2AMEN1SMN1; SMN2ALDH1A1CYP3A4
SCHEMBL4308718 0.74 HMOX1 (0.38) KMT2A
SCHEMBL4310328 0.71 ALOX5 (0.45) L3MBTL1SMN1; SMN2
SCHEMBL13667447 0.70 MEN1 (0.37) KDM4EMAPK1KMT2AMEN1ALDH1A1
SCHEMBL13667446 0.70 MEN1 (0.37) KDM4EMAPK1KMT2AMEN1ALDH1A1
SCHEMBL4304793 0.70 ALOX15 (0.39) KDM4EKMT2AMEN1ALDH1A1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1879873-B1 NEUROTHERAPEUTIC AZOLE COMPOUNDS SK BIOPHARMACEUTICALS CO LTD (KR) 2013-10-09 EP disclosed
US-7598279-B2 Neurotherapeutic azole compounds SK HOLDINGS CO., LTD. (KR) 2009-10-06 US disclosed
US-7598279-B2 Neurotherapeutic azole compounds SK HOLDINGS CO., LTD. (KR) 2009-10-06 US disclosed
EP-1879873-A1 NEUROTHERAPEUTIC AZOLE COMPOUNDS SK Holdings Co., Ltd. (KR) 2008-01-23 EP disclosed
US-20060258718-A1 Neurotherapeutic azole compounds SK BIOPHARMACEUTICALS CO., LTD. (KR) 2006-11-16 US disclosed
WO-2006112685-A1 NEUROTHERAPEUTIC AZOLE COMPOUNDS SK HOLDINGS CO., LTD. (KR) 2006-10-26 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-20060258718-A1 Neurotherapeutic azole compounds CHRNA10, CHRNA4, CHRNA3 KDM4E 670/4885MAPK1 2690/4885L3MBTL1 3943/4885

“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.