SCHEMBL14828906

SCHEMBL14828906

CC(C)(C)OC(=O)N1CCN(c2nc3ncc(Br)cc3nc2Cl)CC1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 1/20 0.43
POLB P06746 1/20 0.43
CKS1B P61024 2/20 0.42
SKP1 P63208 2/20 0.42
SKP2 Q13309 2/20 0.42
GBA1 P04062 2/20 0.41
TLR9 Q9NR96 1/20 0.41
MAP4K4 O95819 1/20 0.41
NR1H2 P55055 1/20 0.41
NR1H3 Q13133 1/20 0.41
KIT P10721 2/20 0.41
MET P08581 1/20 0.41
MEN1 O00255 1/20 0.40
MAPT P10636 1/20 0.40
TSHR P16473 1/20 0.40
KMT2A Q03164 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
FNTA P49354 1/20 0.40
FNTB P49356 1/20 0.40
CCNK O75909 1/20 0.40

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
SCHEMBL14829286 0.89 POLB (0.44) POLBCKS1BSKP1SKP2GBA1
SCHEMBL30389146 0.89 POLB (0.44) POLBCKS1BSKP1SKP2GBA1
SCHEMBL14829024 0.86 CKS1B (0.47) POLBCKS1BSKP1SKP2GBA1
SCHEMBL14828914 0.85 KIT (0.43) BACE1CKS1BSKP1SKP2GBA1
SCHEMBL30389013 0.85 KIT (0.43) BACE1CKS1BSKP1SKP2GBA1
SCHEMBL14828999 0.83 ABL1 (0.39) MEN1MAPTKMT2ASMN1; SMN2
SCHEMBL18837988 0.81 MEN1 (0.53) BACE1POLBCKS1BSKP1SKP2
SCHEMBL29182826 0.80 POLB (0.49) BACE1POLBCKS1BSKP1SKP2
SCHEMBL31142819 0.79 TLR9 (0.46) BACE1POLBCKS1BSKP1SKP2
SCHEMBL2402237 0.79 POLB (0.48) POLBCKS1BSKP1SKP2GBA1

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-3461825-B1 NOVEL HETEROCYCLIC DERIVATIVES AND THEIR USES C&C RES LAB (KR) 2023-06-07 EP disclosed
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 BACE1 1404/4885POLB 4222/4885CKS1B 2126/4885

“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.