SCHEMBL5338026

SCHEMBL5338026

O=C(c1ccc2nc(-c3ccc(Cl)cc3)c(-c3ccc(Cl)cc3)n2c1)N1CCN(c2ccccn2)CC1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.56
SLC6A7 Q99884 2/20 0.56
MAPK1 P28482 1/20 0.56
L3MBTL1 Q9Y468 1/20 0.56
KMT2A Q03164 3/20 0.52
MEN1 O00255 2/20 0.52
POLB P06746 1/20 0.52
KDM4E B2RXH2 7/20 0.51
SMN1; SMN2 Q16637 4/20 0.50
HSD17B10 Q99714 3/20 0.50
HPGD P15428 2/20 0.50
NPSR1 Q6W5P4 2/20 0.50
USP2 O75604 1/20 0.50
MAPT P10636 1/20 0.50
TSHR P16473 1/20 0.50
SETD7 Q8WTS6 1/20 0.48
KCNK3 O14649 1/20 0.48
KCNK9 Q9NPC2 1/20 0.48
HTT P42858 1/20 0.48
LMNA P02545 1/20 0.46

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
SCHEMBL5344690 0.86 LMNA (0.54) ALDH1A1SLC6A7KMT2AMEN1POLB
SCHEMBL5341068 0.82 SLC2A2 (0.52)
SCHEMBL5318714 0.82 POLB (0.56) ALDH1A1KMT2APOLBKDM4ESMN1; SMN2
SCHEMBL5337926 0.82 CNR1 (0.58) KMT2AMEN1HSD17B10HPGDKCNK3
SCHEMBL5322233 0.82 CNR1 (0.58) KMT2AMEN1HSD17B10HPGDKCNK3
SCHEMBL3579131 0.81 SLC6A7 (0.83) ALDH1A1SLC6A7MAPK1L3MBTL1KMT2A
SCHEMBL5345220 0.80 KDM4E (0.59) ALDH1A1MAPK1KMT2AKDM4ESMN1; SMN2
SCHEMBL5342501 0.80 CCNC (0.45) ALDH1A1KDM4ESMN1; SMN2HPGDKCNK3
SCHEMBL5339197 0.79 CASP1 (0.49) ALDH1A1KMT2AMEN1KDM4ESMN1; SMN2
SCHEMBL5340730 0.79 ALDH1A1 (0.56) ALDH1A1MAPK1L3MBTL1KMT2AMEN1

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-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