SCHEMBL4308038

SCHEMBL4308038

NC(=O)OC(COc1ccccc1Cl)Cn1cnnn1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 6/20 0.47
KMT2A Q03164 6/20 0.47
HPGD P15428 3/20 0.47
MAPK1 P28482 2/20 0.47
PKM P14618 2/20 0.47
ALDH1A1 P00352 2/20 0.47
MAPT P10636 1/20 0.47
TSHR P16473 1/20 0.47
HTT P42858 2/20 0.41
USP2 O75604 1/20 0.41
RAB9A P51151 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.39
TP53 P04637 1/20 0.39
POLB P06746 2/20 0.37
CTDSP1 Q9GZU7 1/20 0.37
CYP1A2 P05177 1/20 0.36
GAA P10253 1/20 0.36
CYP2C19 P33261 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
KDM4E B2RXH2 1/20 0.35

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
SCHEMBL4311966 0.81 CYP1A2 (0.46) MEN1KMT2AMAPTTSHRPOLB
SCHEMBL4311700 0.81 POLB (0.43) MEN1KMT2AHPGDMAPK1PKM
SCHEMBL4312614 0.80 KMT2A (0.43) MEN1KMT2AHPGDMAPK1PKM
SCHEMBL13667365 0.78 AVPR2 (0.40) MEN1KMT2AHPGDMAPK1PKM
SCHEMBL4310318 0.78 AVPR2 (0.40) MEN1KMT2AHPGDMAPK1PKM
SCHEMBL13667364 0.78 AVPR2 (0.40) MEN1KMT2AHPGDMAPK1PKM
SCHEMBL4309927 0.77 HMOX1 (0.47) MEN1KMT2APKMALDH1A1RAB9A
SCHEMBL4313231 0.77 MEN1 (0.48) MEN1KMT2APKMALDH1A1USP2
SCHEMBL13667446 0.76 MEN1 (0.37) MEN1KMT2AHPGDMAPK1PKM
SCHEMBL13667447 0.76 MEN1 (0.37) MEN1KMT2AHPGDMAPK1PKM

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 MEN1 1549/4885KMT2A 1096/4885HPGD 2280/4885

“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.