SCHEMBL4306763

SCHEMBL4306763

NC(=O)OC(Cn1nccn1)c1ccc(C(F)(F)F)cc1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 2/20 0.41
UTS2R Q9UKP6 2/20 0.37
FFAR1 O14842 5/20 0.37
CES2 O00748 1/20 0.36
CES1 P23141 1/20 0.36
IKBKB O14920 1/20 0.36
AKT1 P31749 1/20 0.35
PPARG P37231 1/20 0.35
SCN9A Q15858 1/20 0.35
SLC6A9 P48067 1/20 0.35
GLP1R P43220 1/20 0.35
GCGR P47871 1/20 0.35
GIPR P48546 1/20 0.35
ACP3 P15309 1/20 0.35

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
SCHEMBL4315967 0.86 PNMT (0.47) CES2AKT1ACP3
SCHEMBL4312963 0.85 KIF11 (0.38) KIF11UTS2RFFAR1CES2CES1
SCHEMBL4310334 0.85 PTGS2 (0.39)
SCHEMBL4314230 0.83 RPS6KB1 (0.41) AKT1PPARG
SCHEMBL4321687 0.82 CYP1A2 (0.38) UTS2R
SCHEMBL13667413 0.82 CYP1A2 (0.38) UTS2R
SCHEMBL13667412 0.82 CYP1A2 (0.38) UTS2R
SCHEMBL4308663 0.82 ADRB1 (0.36) UTS2RFFAR1
SCHEMBL4307811 0.82 ADRB1 (0.44)
SCHEMBL4309952 0.82 IDO1 (0.35) CES2CES1AKT1

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 KIF11 440/4885UTS2R 2603/4885FFAR1 902/4885

“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.