SCHEMBL4311892

SCHEMBL4311892

O=C(c1ccc(F)cc1)C1CCN(C(=O)OC(Cn2ncnn2)c2ccc(Cl)cc2Cl)CC1

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 8/20 0.46
MGLL Q99685 4/20 0.46
CYP2C19 P33261 2/20 0.41
CYP2C9 P11712 1/20 0.41
KDM4E B2RXH2 1/20 0.39
POLB P06746 1/20 0.39
GAA P10253 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
ALDH1A1 P00352 1/20 0.39
BLM P54132 1/20 0.39
HTT P42858 1/20 0.38
TDP1 Q9NUW8 1/20 0.38

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
SCHEMBL4316498 0.93 HSD11B1 (0.46) HSD11B1MGLLCYP2C19CYP2C9KDM4E
SCHEMBL4310209 0.91 HSD11B1 (0.48) HSD11B1MGLLCYP2C19CYP2C9POLB
SCHEMBL4309717 0.87 MGLL (0.46) MGLL
SCHEMBL4314261 0.86 HSD11B1 (0.51) HSD11B1MGLLCYP2C19CYP2C9KDM4E
SCHEMBL4318842 0.84 MGLL (0.42) HSD11B1MGLLPOLBALDH1A1
SCHEMBL4309173 0.81 MGLL (0.46) HSD11B1MGLLCYP2C19CYP2C9POLB
SCHEMBL4309687 0.79 CCR3 (0.39)
SCHEMBL4310470 0.78 MEN1 (0.41) CYP2C19CYP2C9KDM4EPOLBALDH1A1
SCHEMBL1582768 0.76 HSD11B1 (0.50) HSD11B1MGLLPOLBSMN1; SMN2HTT
SCHEMBL4311381 0.76 POLB (0.39) MGLLCYP2C19CYP2C9POLB

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 7 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
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 HSD11B1 524/4885MGLL 2866/4885CYP2C19 156/4885

“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.