SCHEMBL29007756

SCHEMBL29007756

CCOC(=O)c1cn(-c2ncccn2)c2cc(F)c(Cl)cc2c1=O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.50
▸ LMNA P02545 2/20 0.50
▸ MAPT P10636 1/20 0.50
▸ KMT2A Q03164 2/20 0.49
▸ NPC1 O15118 1/20 0.47
▸ POLB P06746 1/20 0.45
▸ STAT3 P40763 2/20 0.43
▸ ROCK2 O75116 1/20 0.42
▸ CDK1 P06493 1/20 0.42
▸ PRKACA P17612 1/20 0.42
▸ CDK2 P24941 1/20 0.42
▸ CSNK1D P48730 1/20 0.42
▸ GSK3A P49840 1/20 0.42
▸ CDK5 Q00535 1/20 0.42
▸ PRKCD Q05655 1/20 0.42
▸ ROCK1 Q13464 1/20 0.42
▸ CDC42BPA Q5VT25 1/20 0.42
▸ MARK2 Q7KZI7 1/20 0.42
▸ KDM4E B2RXH2 3/20 0.42
▸ HPGD P15428 3/20 0.42

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
SCHEMBL29008017 0.84 KMT2A (0.46) ALDH1A1LMNAMAPTKMT2ANPC1
SCHEMBL30181185 0.84 KMT2A (0.46) ALDH1A1LMNAMAPTKMT2ANPC1
SCHEMBL30417471 0.84 KMT2A (0.46) ALDH1A1LMNAMAPTKMT2ANPC1
SCHEMBL30417741 0.83 PIK3CG (0.40) ALDH1A1LMNAKMT2AKDM4EHPGD
SCHEMBL29008015 0.83 PIK3CG (0.40) ALDH1A1LMNAKMT2AKDM4EHPGD
SCHEMBL10471948 0.82 NPC1 (0.60) ALDH1A1LMNAMAPTKMT2ANPC1
SCHEMBL30298033 0.82 NPC1 (0.53) ALDH1A1LMNAMAPTKMT2ANPC1
SCHEMBL30954837 0.81 NPC1 (0.52) ALDH1A1LMNAMAPTKMT2ANPC1
SCHEMBL30954825 0.81 NPC1 (0.54) ALDH1A1LMNAMAPTKMT2ANPC1
SCHEMBL30297962 0.81 NPC1 (0.52) ALDH1A1LMNAMAPTKMT2ANPC1

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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