SCHEMBL6925928

SCHEMBL6925928

COc1ccc(CNc2nc3ccccc3c3c2nc(-c2ccccc2)n3CCC2CCN(C(=O)OC(C)(C)C)CC2)cc1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TP53 P04637 7/20 0.49
LMNA P02545 4/20 0.46
TLR9 Q9NR96 1/20 0.44
ACP1 P24666 2/20 0.43
TDP1 Q9NUW8 1/20 0.42
DNMT3A Q9Y6K1 1/20 0.42
ALDH1A1 P00352 1/20 0.42
SLC2A1 P11166 1/20 0.41
KDM4E B2RXH2 1/20 0.41
HSD17B10 Q99714 1/20 0.41
THRB P10828 1/20 0.41
MAPT P10636 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
HTT P42858 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
SCHEMBL6838678 0.82 KDM4E (0.43) TP53LMNATDP1KDM4ETHRB
SCHEMBL6833883 0.80 KDM4E (0.42) TP53LMNATDP1KDM4ETHRB
SCHEMBL6838661 0.80 CETP (0.42) LMNATDP1KDM4E
SCHEMBL6837673 0.78 HPGDS (0.47) TP53LMNATDP1KDM4ETHRB
SCHEMBL6925924 0.76 GPR119 (0.44) TP53LMNATDP1KDM4ETHRB
SCHEMBL6928550 0.73 PTGER4 (0.40) ALDH1A1KDM4EHSD17B10SMN1; SMN2
SCHEMBL6927289 0.71 GBA1 (0.40) TP53LMNATDP1KDM4ETHRB
SCHEMBL6927222 0.70 ACKR3 (0.45) TP53ALDH1A1THRBMAPTSMN1; SMN2
SCHEMBL6929687 0.70 KDM4E (0.39) LMNAALDH1A1KDM4EHSD17B10
SCHEMBL6838066 0.69 BRD4 (0.43) TP53ACP1HSD17B10

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
US-6518265-B1 1H-imidazopyridine derivatives HOKURIKU SEIYAKU CO., LTD. (JP) 2003-02-11 US disclosed
EP-1104764-A1 1H-IMIDAZOPYRIDINE DERIVATIVES HOKURIKU SEIYAKU CO., LTD. (JP) 2001-06-06 EP disclosed