SCHEMBL23328483

SCHEMBL23328483

N#Cc1ccc(-c2ccc(N(c3ccc(-c4ccc(C#N)cc4)cc3)c3ccc(-c4ccc5sc6ccccc6c5c4)cc3)cc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRSS12 P56730 1/20 0.41
PIM1 P11309 1/20 0.39
PIM3 Q86V86 1/20 0.39
PIM2 Q9P1W9 1/20 0.39
GPR3 P46089 1/20 0.39
LIMK1 P53667 1/20 0.36
MAP4K4 O95819 1/20 0.36
TNKS O95271 1/20 0.35
APP P05067 1/20 0.35
PTGIR P43119 1/20 0.35
PTGDR2 Q9Y5Y4 1/20 0.35
ABCG2 Q9UNQ0 1/20 0.34
MMP3 P08254 1/20 0.34
ALDH1A1 P00352 1/20 0.34
MAPT P10636 1/20 0.34
HPGD P15428 1/20 0.34
RAB9A P51151 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
GABRA1 P14867 1/20 0.34
GABRG2 P18507 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
SCHEMBL23328465 1.00 PRSS12 (0.41) PRSS12PIM1PIM3PIM2GPR3
SCHEMBL25544160 1.00 PRSS12 (0.41) PRSS12PIM1PIM3PIM2GPR3
SCHEMBL25548015 1.00 PRSS12 (0.41) PRSS12PIM1PIM3PIM2GPR3
SCHEMBL25544250 0.94 GPR3 (0.39) PRSS12PIM1PIM3PIM2GPR3
SCHEMBL23328501 0.94 GPR3 (0.39) PRSS12PIM1PIM3PIM2GPR3
SCHEMBL25544249 0.94 GPR3 (0.39) PRSS12PIM1PIM3PIM2GPR3
SCHEMBL23328481 0.92 GPR3 (0.37) PRSS12PIM1PIM3PIM2GPR3
SCHEMBL25543401 0.92 GPR3 (0.37) PRSS12PIM1PIM3PIM2GPR3
SCHEMBL25544364 0.92 GPR3 (0.37) PRSS12PIM1PIM3PIM2GPR3
SCHEMBL25543723 0.92 PRSS12 (0.40) PRSS12PIM1PIM3PIM2GPR3

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
WO-2021085817-A2 TERTIARY AMINE DERIVATIVE AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING SAME 주식회사 랩토 2021-05-06 WO disclosed