SCHEMBL29862197

SCHEMBL29862197

O=C(c1cccs1)n1nnc2ccccc21

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MGAM O43451 9/20 0.60
▸ AMY1A P0DUB6 9/20 0.60
▸ GAA P10253 9/20 0.60
▸ SI P14410 9/20 0.60
▸ MGAM2 Q2M2H8 9/20 0.60
▸ KMT2A Q03164 5/20 0.60
▸ F2 P00734 1/20 0.60
▸ HPGD P15428 1/20 0.60
▸ SLC9A1 P19634 1/20 0.60
▸ KCNMA1 Q12791 1/20 0.56
▸ F12 P00748 7/20 0.55
▸ KDM4E B2RXH2 2/20 0.53
▸ MEN1 O00255 1/20 0.53
▸ NPC1 O15118 1/20 0.53
▸ RAB9A P51151 1/20 0.53
▸ SMN1; SMN2 Q16637 1/20 0.53
▸ MAPT P10636 2/20 0.52
▸ ALDH1A1 P00352 1/20 0.52
▸ HTT P42858 1/20 0.52
▸ NPSR1 Q6W5P4 1/20 0.52

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
SCHEMBL2490904 1.00 MGAM (0.60) MGAMAMY1AGAASIMGAM2
SCHEMBL28580722 0.80 GAA (0.48) MGAMAMY1AGAASIMGAM2
SCHEMBL3900498 0.77 KCNMA1 (0.81) MGAMAMY1AGAASIMGAM2
SCHEMBL2493561 0.76 MGAM (1.00) MGAMAMY1AGAASIMGAM2
SCHEMBL29433322 0.76 MGAM (1.00) MGAMAMY1AGAASIMGAM2
SCHEMBL15203111 0.75 MGAM (0.62) MGAMAMY1AGAASIMGAM2
SCHEMBL2491371 0.75 MGAM (0.79) MGAMAMY1AGAASIMGAM2
SCHEMBL4250719 0.75 GAA (0.68) MGAMAMY1AGAASIMGAM2
SCHEMBL706083 0.75 MGAM (0.68) MGAMAMY1AGAASIMGAM2
SCHEMBL170673 0.73 GAA (0.71) MGAMAMY1AGAASIMGAM2

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-114901866-A Metal coated substrate 阿梅迪洛金属涂层有限公司 2022-08-12 — — CN claimed
EP-4051823-A1 METALLIC COATED SUBSTRATES Armadillo Metal Coatings Ltd (GB) 2022-09-07 — — EP disclosed
CN-114901866-A Metal coated substrate 阿梅迪洛金属涂层有限公司 2022-08-12 — — CN disclosed
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