SCHEMBL4308035

SCHEMBL4308035

NC(=O)OC(Cn1nccn1)c1cccc(Cl)c1

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ADRA1D P25100 1/20 0.39
AOC3 Q16853 1/20 0.39
IDO1 P14902 1/20 0.38
DCAF1 Q9Y4B6 1/20 0.38
ACP3 P15309 1/20 0.37
AURKA O14965 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 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
SCHEMBL4313087 0.85 PLA2G1B (0.38) ADRA1DAOC3IDO1DCAF1AURKA
SCHEMBL4307876 0.85 AOC3 (0.40) AOC3ACP3
SCHEMBL4321687 0.84 CYP1A2 (0.38) MEN1KMT2A
SCHEMBL13667413 0.84 CYP1A2 (0.38) MEN1KMT2A
SCHEMBL13667412 0.84 CYP1A2 (0.38) MEN1KMT2A
SCHEMBL4307811 0.84 ADRB1 (0.44)
SCHEMBL13667414 0.83 TNF (0.38) AURKA
SCHEMBL4309855 0.83 TNF (0.38) AURKA
SCHEMBL13667427 0.83 TNF (0.38) AURKA
SCHEMBL4315967 0.82 PNMT (0.47) IDO1ACP3

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 ADRA1D 2300/4885AOC3 1599/4885IDO1 830/4885

“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.