SCHEMBL9304510

SCHEMBL9304510

CCCc1nn2ncc(C(=O)O)c2[nH]1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR4A3 Q92570 1/20 0.35
KDM5B Q9UGL1 4/20 0.35
KDM5A P29375 1/20 0.35
KDM6B O15054 3/20 0.33
KDM4A O75164 3/20 0.33
KDM4D Q6B0I6 3/20 0.33
KDM3B Q7LBC6 3/20 0.33
HIF1AN Q9NWT6 3/20 0.33
KDM2A Q9Y2K7 3/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
HCAR2 Q8TDS4 1/20 0.33
PLAT P00750 1/20 0.32
SPR P35270 1/20 0.32
KDM4E B2RXH2 2/20 0.32
GABRP O00591 1/20 0.32
GABRD O14764 1/20 0.32
GABRA1 P14867 1/20 0.32
GABRB1 P18505 1/20 0.32
GABRG2 P18507 1/20 0.32
GABRB3 P28472 1/20 0.32

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
SCHEMBL9140120 0.78 GLA (0.34) PLAT
SCHEMBL7968120 0.76 SPR (0.38) NR4A3KDM6BKDM4AKDM4DHIF1AN
SCHEMBL9138406 0.69 L3MBTL1 (0.31) L3MBTL1PLATGABRA1GABRA5GABRB2
SCHEMBL28921667 0.63 KDM4E (0.44) NR4A3HCAR2SPRKDM4EGABRP
SCHEMBL7424613 0.63 MMP2 (0.48) KDM5BKDM5AKDM6BKDM4AKDM4D
SCHEMBL3291164 0.62 NR4A3 (0.44) NR4A3L3MBTL1KDM4EGABRPGABRD
SCHEMBL9140123 0.62 KDM4C (0.33)
SCHEMBL21893562 0.60 KDM4E (0.45) NR4A3HCAR2SPRKDM4EGABRP
SCHEMBL7303922 0.60 NR4A3 (0.42) NR4A3KDM4EALDH1A1MAPTGAA
SCHEMBL773204 0.60 NR4A3 (0.78) NR4A3ALDH1A1MAPTGAAMAPK1

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
US-5354766-A 2-Ethoxy-1-((2'(2,5-dihydro-5-oxo-1,2,4-oxadiazol-3-yl) biphenyl-4-yl)methyl)benzimidazole-7-carboxylic acid; hypotensive agents; CNS activity TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1994-10-11 US disclosed