Sugi Predict

Sugi Predict / Compounds / SCHEMBL30417566

SCHEMBL30417566

SCHEMBL30417566

CCOC(=O)c1cn(-c2ccc(N3CC(N(C)C)C3)nc2)c2ncccc2c1=O

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ ELANE P08246 4/20 0.46
▸ KCNH2 Q12809 12/20 0.44
▸ PDE4A P27815 11/20 0.44
▸ CSF1R P07333 1/20 0.39
▸ MEN1 O00255 1/20 0.37
▸ LMNA P02545 1/20 0.37
▸ MAPK1 P28482 1/20 0.37
▸ HTT P42858 1/20 0.37
▸ KMT2A Q03164 1/20 0.37

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
SCHEMBL30417628 0.88 MAPK8 (0.39) ELANECSF1RMEN1LMNAMAPK1
SCHEMBL30417373 0.88 KCNH2 (0.48) KCNH2PDE4A
SCHEMBL30181156 0.84 CSF1R (0.41) KCNH2CSF1RMEN1LMNAKMT2A
SCHEMBL29007900 0.84 CSF1R (0.41) KCNH2CSF1RMEN1LMNAKMT2A
SCHEMBL30181266 0.81 NPC1 (0.41) PDE4ACSF1RMEN1LMNAHTT
SCHEMBL29007976 0.81 NPC1 (0.41) PDE4ACSF1RMEN1LMNAHTT
SCHEMBL29007911 0.80 NPC1 (0.45) MEN1LMNAHTTKMT2A
SCHEMBL30181102 0.80 NPC1 (0.45) MEN1LMNAHTTKMT2A
SCHEMBL7176953 0.80 KCNH2 (0.54) ELANEKCNH2PDE4A
SCHEMBL7192676 0.79 ELANE (0.58) ELANEKCNH2PDE4ALMNA

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-116157392-A Compounds targeting RNA binding proteins or RNA modification proteins 雷多纳治疗公司 2023-05-23 — — CN disclosed
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