SCHEMBL31327697

SCHEMBL31327697

COc1cc2c(cc1C(=O)NC1CCN(C)CC1)sc1nc(-c3ccc(C4CCN(C(=O)OC(C)(C)C)C4)cc3F)cn12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDE4B Q07343 1/20 0.42
▸ USP30 Q70CQ3 2/20 0.42
▸ MAPT P10636 6/20 0.41
▸ ALDH1A1 P00352 4/20 0.41
▸ KDM4E B2RXH2 3/20 0.41
▸ HPGD P15428 2/20 0.41
▸ ALOX15 P16050 1/20 0.40
▸ HSD17B10 Q99714 1/20 0.40
▸ NPC1 O15118 1/20 0.39
▸ ATM Q13315 1/20 0.39
▸ LCK P06239 1/20 0.39
▸ JAK3 P52333 1/20 0.39
▸ BTK Q06187 1/20 0.39
▸ TP53 P04637 3/20 0.39
▸ POLB P06746 1/20 0.39
▸ LMNA P02545 1/20 0.39
▸ THRB P10828 2/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ CRHBP P24387 1/20 0.38
▸ KMT2A Q03164 1/20 0.38

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
SCHEMBL30727242 1.00 PDE4B (0.42) PDE4BUSP30MAPTALDH1A1KDM4E
SCHEMBL26985371 1.00 PDE4B (0.42) PDE4BUSP30MAPTALDH1A1KDM4E
SCHEMBL31327740 0.91 PDE4B (0.45) PDE4BUSP30MAPTALDH1A1KDM4E
SCHEMBL30727281 0.91 PDE4B (0.45) PDE4BUSP30MAPTALDH1A1KDM4E
SCHEMBL26985173 0.91 PDE4B (0.45) PDE4BUSP30MAPTALDH1A1KDM4E
SCHEMBL30727293 0.89 PDE4B (0.46) PDE4BUSP30LCKJAK3BTK
SCHEMBL26985423 0.89 PDE4B (0.46) PDE4BUSP30LCKJAK3BTK
SCHEMBL31327687 0.89 ROCK2 (0.42) MAPTALDH1A1KDM4EHPGDALOX15
SCHEMBL31327696 0.89 ROCK2 (0.42) MAPTALDH1A1KDM4EHPGDALOX15
SCHEMBL30727208 0.89 ROCK2 (0.42) MAPTALDH1A1KDM4EHPGDALOX15

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-119255997-A Modulators of c-MYC mRNA translation and their use in the treatment of cancer 艾尼莫生物科技公司 2025-01-03 — — CN disclosed
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