SCHEMBL4308718

SCHEMBL4308718

NC(=O)OC(Cn1cnnn1)c1ccc(Oc2ccccc2)cc1

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HMOX1 P09601 1/20 0.38
KMT2A Q03164 3/20 0.38
PARP10 Q53GL7 1/20 0.38
ADRB1 P08588 1/20 0.38
HTR2A P28223 1/20 0.38
HTR2B P41595 1/20 0.38
SIGMAR1 Q99720 1/20 0.38
FFAR1 O14842 1/20 0.38
TP53 P04637 1/20 0.38
SRD5A2 P31213 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
SCHEMBL4304627 0.90 HMOX1 (0.43) HMOX1KMT2ATP53
SCHEMBL4310328 0.87 ALOX5 (0.45) HMOX1PARP10FFAR1
SCHEMBL4321585 0.84 TNIK (0.40) HMOX1KMT2ATP53
SCHEMBL4306543 0.80 NPC1 (0.38) KMT2ATP53
SCHEMBL4311505 0.79 TP53 (0.47) ADRB1HTR2AHTR2BSIGMAR1TP53
SCHEMBL4310159 0.79 SCN4A (0.38) PARP10ADRB1HTR2AHTR2BSIGMAR1
SCHEMBL13667426 0.78 MAPK1 (0.45) KMT2AFFAR1
SCHEMBL4309086 0.78 DPP4 (0.36) HMOX1
SCHEMBL13667364 0.76 AVPR2 (0.40) HMOX1KMT2ATP53
SCHEMBL4310318 0.76 AVPR2 (0.40) HMOX1KMT2ATP53

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 5 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
US-20060258718-A1 Neurotherapeutic azole compounds SK BIOPHARMACEUTICALS CO., LTD. (KR) 2006-11-16 US 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 HMOX1 1965/4885KMT2A 1096/4885PARP10 3064/4885

“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.