SCHEMBL10768873

SCHEMBL10768873

O=C(O)c1cnc(Cn2cnnc2)c(C(=O)O)c1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MGAM O43451 1/20 0.35
▸ SLC22A12 Q96S37 3/20 0.34
▸ P4HA1 P13674 2/20 0.33
▸ P4HTM Q9NXG6 2/20 0.33
▸ POLB P06746 2/20 0.33
▸ TBXAS1 P24557 1/20 0.33
▸ KDM5A P29375 1/20 0.33
▸ KDM4C Q9H3R0 1/20 0.33
▸ KDM5B Q9UGL1 1/20 0.33
▸ PLAA Q9Y263 1/20 0.33
▸ MIF P14174 1/20 0.33
▸ HCAR3 P49019 1/20 0.32
▸ ALPG P10696 1/20 0.32
▸ HCAR2 Q8TDS4 4/20 0.32
▸ KDM4E B2RXH2 2/20 0.32
▸ ALDH1A1 P00352 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

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
SCHEMBL10768907 0.84 MGAM (0.38) MGAMSLC22A12P4HA1P4HTMKDM5A
SCHEMBL10770003 0.82 TBXAS1 (0.50) TBXAS1MEN1LMNAKMT2A
Oxalic Acid SCHEMBL10766927 0.80 TBXAS1 (0.48) TBXAS1MEN1LMNAKMT2A
SCHEMBL10764140 0.77 HDAC1 (0.41) MEN1KMT2AHSD17B10
SCHEMBL10764581 0.76 HCAR2 (0.41) MGAMP4HA1P4HTMPOLBMIF
SCHEMBL19857480 0.75 GABRP (0.46) MGAMSLC22A12P4HA1P4HTMPOLB
SCHEMBL9037560 0.75 HCAR2 (0.40) MGAMP4HA1P4HTMPOLBMIF
SCHEMBL10766358 0.74 HTT (0.53) MGAMSLC22A12KDM5AKDM4CKDM5B
SCHEMBL29819483 0.72 TSHR (0.44) MGAMP4HA1P4HTMMIFHCAR3
SCHEMBL10447248 0.72 MGAM (0.38) MGAMP4HA1P4HTMPOLBKDM5A

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
EP-0225175-A2 Dihydropyridine derivatives, processes for their preparation and pharmaceutical compositions thereof FISONS plc (GB) 1987-06-10 — — EP claimed
EP-0225175-A2 Dihydropyridine derivatives, processes for their preparation and pharmaceutical compositions thereof FISONS plc (GB) 1987-06-10 — — EP disclosed
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