SCHEMBL5336574

SCHEMBL5336574

CCCCNC(=O)c1c(-c2ccc(Cl)cc2)c(I)cn2ccnc12

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TP53 P04637 2/20 0.48
MDM2 Q00987 1/20 0.48
KDM4E B2RXH2 1/20 0.42
ALDH1A1 P00352 1/20 0.42
HPGD P15428 1/20 0.42
TSHR P16473 1/20 0.42
HSD17B10 Q99714 1/20 0.42
CNR2 P34972 4/20 0.41
CNR1 P21554 4/20 0.40
PDE4B Q07343 1/20 0.40
PDE4D Q08499 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.38
MEN1 O00255 1/20 0.36
LMNA P02545 1/20 0.36
GAA P10253 1/20 0.36
NPY1R P25929 1/20 0.36
NPY2R P49146 1/20 0.36
KMT2A Q03164 1/20 0.36

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
SCHEMBL5344142 0.90 PDE4B (0.39) TP53MDM2CNR2PDE4BPDE4D
SCHEMBL5337097 0.78 SPTLC1 (0.53) TP53MDM2KDM4EALDH1A1HPGD
SCHEMBL5337260 0.75 CNR1 (0.56) KDM4EALDH1A1HPGDTSHRHSD17B10
SCHEMBL5343953 0.74 CNR1 (0.57) CNR2CNR1L3MBTL1
SCHEMBL5341359 0.67 NPC1 (0.51) KDM4EALDH1A1HPGDMEN1KMT2A
SCHEMBL5336571 0.67 CNR1 (0.46) KDM4EALDH1A1HPGDTSHRHSD17B10
SCHEMBL5344217 0.65 LMNA (0.51) TP53ALDH1A1MEN1LMNAKMT2A
SCHEMBL5335055 0.65 NAMPT (0.46) KDM4EALDH1A1HPGDTSHRMEN1
SCHEMBL17460377 0.65 HPGD (0.55) ALDH1A1HPGDCNR2CNR1PDE4B
SCHEMBL6359381 0.64 HDAC3 (0.71) HPGDTSHRL3MBTL1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007086080-A2 NOVEL IMIDAZO[1,2-a]PYRIDINE CANNABINOID RECEPTOR LIGANDS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM GLENMARK PHARMACEUTICALS LIMITED (IN) 2007-08-02 WO claimed
WO-2007086080-A2 NOVEL IMIDAZO[1,2-a]PYRIDINE CANNABINOID RECEPTOR LIGANDS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM GLENMARK PHARMACEUTICALS LIMITED (IN) 2007-08-02 WO disclosed