SCHEMBL29407144

SCHEMBL29407144

CSc1nc(N(C)C(=O)[C@@H](N)[C@@H](C)O)c2ncn([C@]3(C(N)=O)O[C@H](CO)[C@@H](O)[C@H]3O)c2n1

nearest known ligand 0.37

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.31
▸ PKM P14618 1/20 0.31
▸ ANPEP P15144 5/20 0.31
▸ NPEPPS P55786 5/20 0.31
▸ HTR2C P28335 1/20 0.30
▸ HTR2B P41595 1/20 0.30

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
SCHEMBL29043762 1.00 KDM4E (0.31) KDM4EPKMANPEPNPEPPSHTR2C
SCHEMBL28521252 0.88 HTR2C (0.31) KDM4EPKMHTR2CHTR2B
SCHEMBL31192291 0.88 HTR2C (0.31) KDM4EPKMHTR2CHTR2B
SCHEMBL29835052 0.86 ADORA2A (0.38) ANPEPNPEPPS
SCHEMBL26981136 0.86 ADORA2A (0.38) ANPEPNPEPPS
SCHEMBL26090156 0.85 HTR2B (0.35) KDM4EPKMHTR2CHTR2B
SCHEMBL29413061 0.85 HTR2B (0.35) KDM4EPKMHTR2CHTR2B
SCHEMBL31228871 0.81 NPEPPS (0.35) ANPEPNPEPPS
SCHEMBL28417275 0.80 ADORA3 (0.33) KDM4EPKM
SCHEMBL31439405 0.80 ADORA3 (0.33) KDM4EPKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115362000-A Gene therapy for neurodegenerative disorders using polynucleotide silencing and replacement 帕罗斯生物公司 2022-11-18 — — CN disclosed
CN-115044570-A RNA-guided eradication of human JC virus and other polyomaviruses 英联邦高等教育系统天普大学 2022-09-13 — — CN disclosed
CN-114206849-A Therapeutic methods for treating non-infectious ocular immunoinflammatory disorders 斯格本斯眼科研究所有限公司 2022-03-18 — — CN disclosed
CN-107406854-B RNA-guided eradication of human JC virus and other polyomaviruses 英联邦高等教育系统天普大学 2022-03-11 — — CN disclosed
CN-107949424-B TAT-induced CRISPR/endonuclease-based gene editing 天普大学-联邦高等教育系统 2022-03-01 — — CN disclosed
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