SCHEMBL22933034

SCHEMBL22933034

N#Cc1ccc(C(=O)Nc2cccc(N3CCNCC3)n2)c(F)c1

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ PKM P14618 1/20 0.50
▸ SMN1; SMN2 Q16637 3/20 0.48
▸ ALDH1A1 P00352 2/20 0.48
▸ LMNA P02545 1/20 0.48
▸ L3MBTL1 Q9Y468 1/20 0.46
▸ MAPT P10636 3/20 0.45
▸ KMT2A Q03164 3/20 0.45
▸ MEN1 O00255 2/20 0.45
▸ GAA P10253 1/20 0.45
▸ IRAK4 Q9NWZ3 2/20 0.44
▸ THRB P10828 1/20 0.44
▸ MAPK1 P28482 1/20 0.43
▸ HTT P42858 1/20 0.43
▸ HTR1F P30939 2/20 0.43
▸ GPR27 Q9NS67 1/20 0.42
▸ GRM5 P41594 1/20 0.41

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
SCHEMBL29149914 0.83 PRKCQ (0.55) PKMSMN1; SMN2ALDH1A1LMNAIRAK4
SCHEMBL22933033 0.82 KIF18A (0.54) PKMSMN1; SMN2ALDH1A1LMNAL3MBTL1
SCHEMBL22932905 0.80 PKM (0.50) PKMSMN1; SMN2ALDH1A1LMNAL3MBTL1
SCHEMBL23287012 0.78 PKM (0.57) PKMSMN1; SMN2ALDH1A1LMNAL3MBTL1
SCHEMBL29737990 0.78 PKM (0.57) PKMSMN1; SMN2ALDH1A1LMNAL3MBTL1
SCHEMBL22932912 0.77 DPP4 (0.46) ALDH1A1LMNA
SCHEMBL23607125 0.76 PRKCA (0.46) ALDH1A1LMNAKMT2AMEN1GAA
SCHEMBL23607123 0.71 PRKCA (0.48) ALDH1A1IRAK4GRM5
Hydrochloric Acid SCHEMBL28786573 0.71 HRH3 (0.42) ALDH1A1LMNAMAPK1HTT
SCHEMBL22933040 0.70 GPR119 (0.53) PKMSMN1; SMN2ALDH1A1LMNAMAPT

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-2021018023-A1 SMALL MOLECULE GLP-1 RECEPTOR MODULATOR 济南泰达领创医药技术有限公司 2021-02-04 — — WO disclosed
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