SCHEMBL4313231

SCHEMBL4313231

O=C(OC(COc1ccccc1Cl)Cn1cnnn1)N1CCC(Cc2ccccc2)CC1

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.48
KMT2A Q03164 5/20 0.48
KDM4E B2RXH2 2/20 0.48
ALDH1A1 P00352 2/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
CYP2C9 P11712 2/20 0.45
CYP2C19 P33261 2/20 0.45
MAPK14 Q16539 2/20 0.45
HTR2B P41595 1/20 0.45
ATM Q13315 1/20 0.45
FAAH O00519 1/20 0.43
ABCB1 P08183 4/20 0.42
PKM P14618 2/20 0.41
USP2 O75604 1/20 0.41
ALOX15 P16050 1/20 0.41
HSD17B10 Q99714 1/20 0.41
APOBEC3A P31941 1/20 0.40
APOBEC3G Q9HC16 1/20 0.40

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
SCHEMBL4314108 0.88 DRD4 (0.53) MEN1KMT2AALDH1A1SMN1; SMN2FAAH
SCHEMBL4304826 0.85 MEN1 (0.48) MEN1KMT2AKDM4EALDH1A1SMN1; SMN2
SCHEMBL4965210 0.84 DAGLA (0.40) MEN1KMT2AKDM4EALDH1A1SMN1; SMN2
SCHEMBL4309159 0.83 CYP2C9 (0.47) MEN1KMT2AKDM4EALDH1A1SMN1; SMN2
SCHEMBL4310264 0.80 PRMT5 (0.47) MEN1KMT2AALDH1A1FAAH
SCHEMBL4308023 0.78 CCR3 (0.41) MEN1KMT2AKDM4EALDH1A1SMN1; SMN2
SCHEMBL4308038 0.77 MEN1 (0.47) MEN1KMT2AKDM4EALDH1A1SMN1; SMN2
SCHEMBL4312837 0.75 CCR3 (0.42) MEN1KMT2AKDM4EALDH1A1CYP2C9
SCHEMBL4304614 0.74 SPR (0.44) MEN1KMT2AKDM4EALDH1A1SMN1; SMN2
SCHEMBL4308692 0.73 DRD4 (0.52) MEN1KMT2ASMN1; SMN2FAAH

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
EP-1879873-B1 NEUROTHERAPEUTIC AZOLE COMPOUNDS SK BIOPHARMACEUTICALS CO LTD (KR) 2013-10-09 EP disclosed
CN-101228138-B Neurotherapeutic azole compounds SK HOLDINGS CO LTD 2012-11-21 CN 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
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 1096/4885KDM4E 670/4885

“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.