SCHEMBL8296592

SCHEMBL8296592

O=C(NI)c1ccccc1O

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 10/20 0.65
SMN1; SMN2 Q16637 3/20 0.65
GAA P10253 2/20 0.65
MPO P05164 1/20 0.65
HIF1A Q16665 1/20 0.65
LMNA P02545 7/20 0.59
HPGD P15428 7/20 0.59
HTT P42858 5/20 0.59
HSD17B10 Q99714 5/20 0.59
NPC1 O15118 4/20 0.59
TP53 P04637 3/20 0.59
MEN1 O00255 3/20 0.59
KMT2A Q03164 3/20 0.59
CA1 P00915 2/20 0.55
CA9 Q16790 2/20 0.55
ALDH1A1 P00352 7/20 0.54
CA12 O43570 1/20 0.54
CA2 P00918 1/20 0.54
HMGB1 P09429 1/20 0.54
CA4 P22748 1/20 0.54

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
SCHEMBL23117963 0.83 ALOX5 (0.59) KDM4ESMN1; SMN2GAAMPOHIF1A
SCHEMBL70688 0.81 KDM4E (0.71) KDM4ESMN1; SMN2GAAMPOHIF1A
SCHEMBL77381 0.81 CA1 (0.77) KDM4ESMN1; SMN2GAAMPOHIF1A
Salicylhydroxamic Acid SCHEMBL21530845 0.79 KDM4E (1.00) KDM4ESMN1; SMN2GAAMPOHIF1A
Salicylhydroxamic Acid SCHEMBL144849 0.79 KDM4E (1.00) KDM4ESMN1; SMN2GAAMPOHIF1A
SCHEMBL1783556 0.77 ALDH1A1 (0.64) KDM4ESMN1; SMN2GAAHPGDHTT
SCHEMBL27583795 0.77 MEN1 (0.62) KDM4ESMN1; SMN2GAAMPOHIF1A
SCHEMBL161525 0.77 KDM4E (0.65) KDM4ESMN1; SMN2GAAMPOHIF1A
SCHEMBL1799299 0.77 KDM4E (0.65) KDM4ESMN1; SMN2GAAMPOHIF1A
SCHEMBL3225038 0.77 KDM4E (0.65) KDM4ESMN1; SMN2GAAMPOHIF1A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116063505-B Anti-GAL 3 antibodies and uses thereof 真和制药有限公司 2024-05-03 CN disclosed
CN-117916269-A Method for preventing aggregation of proteins 真和制药有限公司 2024-04-19 CN disclosed
WO-2005007124-A2 SUBSTITUTED DIHYDROPYRIMIDINE INHIBITORS OF CALCIUM CHANNEL FUNCTION BRISTOL-MYERS SQUIBB COMPANY (US) 2005-01-27 WO disclosed