SCHEMBL4316140

SCHEMBL4316140

O=C(OC(Cn1ncnn1)c1ccccc1Cl)N1CCC(c2ccc(Cl)cc2)C1

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.42
TP53 P04637 3/20 0.42
MAPT P10636 3/20 0.42
NPC1 O15118 1/20 0.42
NFKB1 P19838 1/20 0.42
RAB9A P51151 1/20 0.42
NFKB2 Q00653 1/20 0.42
RELA Q04206 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
HSD11B1 P28845 4/20 0.39
CNR1 P21554 2/20 0.38
CCR1 P32246 4/20 0.37
MGLL Q99685 1/20 0.36
PROKR1 Q8TCW9 1/20 0.36
SPR P35270 1/20 0.36
POLB P06746 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
SCHEMBL4304494 0.86 FAAH (0.39) CNR1MGLLSPRPOLB
SCHEMBL4309717 0.85 MGLL (0.46) MGLL
SCHEMBL4309032 0.84 FAAH (0.41) MGLLSPR
SCHEMBL4308697 0.83 POLB (0.36) NPC1HSD11B1CNR1POLB
SCHEMBL4311381 0.83 POLB (0.39) LMNAMAPTCNR1MGLLPOLB
SCHEMBL4313590 0.81 POLB (0.37) POLB
SCHEMBL4318842 0.81 MGLL (0.42) HSD11B1MGLLPOLB
SCHEMBL4306705 0.81 SPR (0.44) SPRPOLB
SCHEMBL4308048 0.81 POLB (0.35) NPC1CNR1POLB
SCHEMBL13667456 0.80 FAAH (0.47) SMN1; SMN2SPRPOLB

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 LMNA 2467/4885TP53 4534/4885MAPT 38/4885

“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.