SCHEMBL30979125

SCHEMBL30979125

Nc1nc2nncn2c2cc(N=O)ccc12

nearest known ligand 0.34

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.34
▸ MAPT P10636 1/20 0.32
▸ ALDH1A1 P00352 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
SCHEMBL30979090 0.80 KDM4E (0.39) KDM4EMAPTALDH1A1
SCHEMBL30979120 0.75 HRH4 (0.46) MAPTALDH1A1
SCHEMBL30978936 0.74 KDM4E (0.34) KDM4EMAPTALDH1A1
SCHEMBL30978941 0.74 MAT2A (0.48) KDM4EMAPTALDH1A1
SCHEMBL29909498 0.73 SMN1; SMN2 (0.46) KDM4EMAPTALDH1A1
SCHEMBL30978935 0.73 CYP1A1 (0.41) KDM4EMAPTALDH1A1
SCHEMBL30048544 0.69 MAPT (0.39) KDM4EMAPT
SCHEMBL30979089 0.68 MAT2A (0.37) KDM4EALDH1A1
SCHEMBL30979084 0.63 TOP2A (0.43) KDM4EMAPTALDH1A1
SCHEMBL30920881 0.62 TNKS2 (0.37) MAPTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118324767-A Diacylglycerol kinase modulating compounds 卡尔那生物科学株式会社 2024-07-12 — — CN disclosed
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