SCHEMBL20193265

SCHEMBL20193265

CC(C)(C)OC(=O)N1CCC(n2cc(-c3cn(COCCS(C)(C)C)nc3Cl)c3cc(Br)ncc32)CC1

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 12/20 0.39
PRKCG P05129 1/20 0.37
PRKCB P05771 1/20 0.37
PRKCA P17252 1/20 0.37
PRKCH P24723 1/20 0.37
PRKCE Q02156 1/20 0.37
PRKCD Q05655 1/20 0.37
KDM1A O60341 1/20 0.35
SRC P12931 2/20 0.34
MET P08581 1/20 0.34
STS P08842 1/20 0.34
SCN9A Q15858 1/20 0.34
CYP3A4 P08684 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
SCHEMBL16608659 0.91 PRKCG (0.37) GPR119PRKCGPRKCBPRKCAPRKCH
SCHEMBL19114604 0.91 PRKCG (0.37) GPR119PRKCGPRKCBPRKCAPRKCH
SCHEMBL19629574 0.88 GPR119 (0.38) GPR119PRKCGPRKCBPRKCAPRKCH
SCHEMBL19114165 0.88 GPR119 (0.42) GPR119PRKCGPRKCBPRKCAPRKCH
SCHEMBL20193157 0.85
SCHEMBL19629423 0.80 IL1B (0.33) GPR119SRCSCN9A
SCHEMBL20193213 0.80 GPR119 (0.36) GPR119SRC
SCHEMBL19629472 0.80 SCN9A (0.36) GPR119KDM1ASRCSCN9A
SCHEMBL20193218 0.79 GPR119 (0.37) GPR119KDM1A
SCHEMBL19626265 0.78 PRKCG (0.37) GPR119PRKCGPRKCBPRKCAPRKCH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9981963-B2 3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-c]pyridine derivatives as NIK inhibitors JANSSEN PHARMACEUTICA NV (BE) 2018-05-29 US disclosed