SCHEMBL14828895

SCHEMBL14828895

CC(C)(C)OC(=O)N1CC(COc2nc3ncc(Br)cc3nc2Cl)C1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FNTA P49354 1/20 0.38
FNTB P49356 1/20 0.38
IDO1 P14902 1/20 0.37
TDO2 P48775 1/20 0.37
ALOX5AP P20292 2/20 0.37
FEN1 P39748 2/20 0.37
GPR119 Q8TDV5 2/20 0.37
SLC5A1 P13866 1/20 0.36
SLC5A2 P31639 1/20 0.36
KCNK3 O14649 1/20 0.35
KCNK9 Q9NPC2 1/20 0.35
CHEK2 O96017 1/20 0.35
NAMPT P43490 1/20 0.35
NR1H2 P55055 1/20 0.34
TLR7 Q9NYK1 1/20 0.34
RBP4 P02753 1/20 0.34
POLB P06746 1/20 0.34
USP30 Q70CQ3 1/20 0.34
JAK3 P52333 1/20 0.34
RORC P51449 1/20 0.34

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
SCHEMBL14829207 0.86 IDO1 (0.38) FNTAFNTBIDO1TDO2ALOX5AP
SCHEMBL14829334 0.83 IDO1 (0.43) FNTAFNTBIDO1TDO2GPR119
SCHEMBL29969696 0.79 ALOX5AP (0.44) FNTAFNTBIDO1TDO2ALOX5AP
SCHEMBL21513745 0.79 ALOX5AP (0.44) FNTAFNTBIDO1TDO2ALOX5AP
SCHEMBL14829159 0.77 HRH4 (0.46) IDO1TDO2ALOX5APFEN1KCNK3
SCHEMBL14230857 0.77 ALOX5AP (0.41) IDO1TDO2ALOX5APFEN1GPR119
SCHEMBL14828906 0.76 BACE1 (0.43) FNTAFNTBGPR119NR1H2POLB
SCHEMBL29308759 0.76 ALOX5AP (0.44) IDO1TDO2ALOX5APFEN1GPR119
SCHEMBL29968865 0.75 IDO1 (0.39) FNTAFNTBIDO1TDO2ALOX5AP
SCHEMBL26590176 0.75 IDO1 (0.39) FNTAFNTBIDO1TDO2ALOX5AP

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3461825-A1 NOVEL HETEROCYCLIC DERIVATIVES AND THEIR USES C&C Research Laboratories (KR) 2019-04-03 EP disclosed
EP-2760865-B1 NOVEL HETEROCYCLIC DERIVATIVES AND THEIR USES C&C RES LAB (KR) 2018-07-11 EP disclosed
US-9586959-B2 Substituted tricyclic heterocycles as histamine 4 receptor inhibitors C&C RESEARCH LABORATORIES (KR) 2017-03-07 US disclosed
US-20140315888-A1 NOVEL HETEROCYCLIC DERIVATIVES AND THEIR USES C&C RESEARCH LABORATORIES (KR) 2014-10-23 US disclosed
EP-2760865-A2 NOVEL HETEROCYCLIC DERIVATIVES AND THEIR USES C&C Research Laboratories (KR) 2014-08-06 EP disclosed
WO-2013048214-A2 NOVEL HETEROCYCLIC DERIVATIVES AND THEIR USES C&C RESEARCH LABORATORIES (KR) 2013-04-04 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-20140315888-A1 NOVEL HETEROCYCLIC DERIVATIVES AND THEIR USES HRH4, HRH2, HRH1 FNTA 2854/4885FNTB 4154/4885IDO1 148/4885

“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.