SCHEMBL29660282

SCHEMBL29660282

Nc1ccccc1-c1c2nc(c(-c3ccccc3N)c3ccc([nH]3)c(-c3ccccc3N)c3nc(c(-c4ccccc4N)c4ccc1[nH]4)C=C3)C=C2

nearest known ligand 0.61

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ TOP1 P11387 2/20 0.46
▸ ALDH1A1 P00352 2/20 0.45
▸ NPC1 O15118 2/20 0.45
▸ RAB9A P51151 2/20 0.45
▸ KDM4E B2RXH2 1/20 0.45
▸ GLA P06280 1/20 0.45
▸ GAA P10253 1/20 0.45
▸ MAPT P10636 1/20 0.45
▸ HPGD P15428 1/20 0.45
▸ SMN1; SMN2 Q16637 1/20 0.45
▸ NPSR1 Q6W5P4 1/20 0.45
▸ HSD17B10 Q99714 1/20 0.45
▸ TERT O14746 2/20 0.42
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ CYCS P99999 2/20 0.41
▸ ENPP2 Q13822 1/20 0.40

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
SCHEMBL29669131 1.00 TOP1 (0.46) TOP1ALDH1A1NPC1RAB9AKDM4E
SCHEMBL38286 1.00 TOP1 (0.46) TOP1ALDH1A1NPC1RAB9AKDM4E
SCHEMBL10337099 0.98 TOP1 (0.45) TOP1ALDH1A1NPC1RAB9AKDM4E
SCHEMBL8349653 0.92 TOP1 (0.51) TOP1ALDH1A1HSD17B10TERTCYCS
SCHEMBL28121945 0.92 TOP1 (0.51) TOP1ALDH1A1HSD17B10TERTCYCS
SCHEMBL27958995 0.92 TOP1 (0.51) TOP1ALDH1A1HSD17B10TERTCYCS
SCHEMBL29714914 0.92 TOP1 (0.51) TOP1ALDH1A1HSD17B10TERTCYCS
SCHEMBL9388930 0.87 TOP1 (0.50) TOP1ALDH1A1NPC1RAB9AKDM4E
SCHEMBL7261395 0.84 TOP1 (0.47) TOP1TERTCYCSENPP2
SCHEMBL5011854 0.82 STAT3 (0.60) TOP1ALDH1A1NPC1RAB9AKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113555564-B Preparation of supported non-noble metal electrocatalyst with MIL-88 as carrier and application of supported non-noble metal electrocatalyst in oxygen reduction reaction 大连民族大学 2023-06-20 — — CN claimed
CN-114497724-B Solid electrolyte and preparation method and application thereof 苏州大学张家港工业技术研究院 2023-05-23 — — CN claimed
CN-114497724-A Solid electrolyte and preparation method and application thereof 苏州大学张家港工业技术研究院 2022-05-13 — — CN claimed
CN-115869999-B Preparation method of steel slag supported catalyst for photocatalysis and steel slag supported catalyst 北京化工大学 2024-08-16 — — CN disclosed
EP-4298101-A1 PORPHYRIN DERIVATIVES AND USES THEREOF University Of Tasmania (AU) 2024-01-03 — — EP disclosed
CN-114497724-B Solid electrolyte and preparation method and application thereof 苏州大学张家港工业技术研究院 2023-05-23 — — CN disclosed
CN-115869999-A Preparation method of steel slag supported catalyst for photocatalysis and steel slag supported catalyst 北京化工大学 2023-03-31 — — CN disclosed
WO-2022178593-A1 PORPHYRIN DERIVATIVES AND USES THEREOF UNIVERSITY OF TASMANIA (AU) 2022-09-01 — — WO disclosed
CN-114497724-A Solid electrolyte and preparation method and application thereof 苏州大学张家港工业技术研究院 2022-05-13 — — CN disclosed
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