SCHEMBL10766358

SCHEMBL10766358

O=C(O)c1cnc(Cn2cccn2)c(C(=O)O)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HTT P42858 1/20 0.53
▸ LMNA P02545 1/20 0.43
▸ KDM5A P29375 1/20 0.42
▸ KDM2B Q8NHM5 1/20 0.42
▸ KDM4C Q9H3R0 1/20 0.42
▸ KDM5B Q9UGL1 1/20 0.42
▸ HDAC1 Q13547 1/20 0.41
▸ HDAC6 Q9UBN7 1/20 0.41
▸ MEN1 O00255 1/20 0.38
▸ TSHR P16473 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ GAA P10253 1/20 0.38
▸ MAPT P10636 1/20 0.38
▸ TDP1 Q9NUW8 1/20 0.36
▸ SLC22A12 Q96S37 2/20 0.35
▸ MGAM O43451 1/20 0.35
▸ BRD4 O60885 1/20 0.35
▸ PRKAB2 O43741 1/20 0.34
▸ PRKAG1 P54619 1/20 0.34
▸ PRKAA2 P54646 1/20 0.34

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 0.82 MGAM (0.38) HTTLMNAKDM5AKDM2BKDM4C
SCHEMBL31172566 0.82 HTT (0.49) HTTLMNAKDM5AKDM2BKDM4C
SCHEMBL10764140 0.78 HDAC1 (0.41) HDAC1HDAC6MEN1TSHRKMT2A
SCHEMBL10770003 0.75 TBXAS1 (0.50) LMNAMEN1KMT2A
SCHEMBL19857480 0.74 GABRP (0.46) MEN1KMT2AMAPTSLC22A12MGAM
SCHEMBL10768873 0.74 MGAM (0.35) LMNAKDM5AKDM4CKDM5BMEN1
SCHEMBL7081878 0.73 HTT (0.75) HTTKDM5AKDM2BKDM4CKDM5B
Oxalic Acid SCHEMBL10766927 0.73 TBXAS1 (0.48) LMNAMEN1KMT2A
SCHEMBL10764581 0.72 HCAR2 (0.41) LMNAMEN1KMT2AMAPTMGAM
SCHEMBL10447248 0.71 MGAM (0.38) LMNAKDM5AKDM4CKDM5BMEN1

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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