SCHEMBL30181049

SCHEMBL30181049

CCOC(=O)c1cn(-c2cnc3c(n2)COC3)c2cc(F)c(Cl)cc2c1=O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 3/20 0.43
▸ NPC1 O15118 1/20 0.43
▸ ALDH1A1 P00352 3/20 0.42
▸ KDM4E B2RXH2 3/20 0.42
▸ HPGD P15428 3/20 0.42
▸ HSD17B10 Q99714 2/20 0.42
▸ LMNA P02545 2/20 0.42
▸ MAPT P10636 1/20 0.42
▸ CYP2C19 P33261 1/20 0.39
▸ POLB P06746 1/20 0.39
▸ STAT3 P40763 2/20 0.38
▸ HTT P42858 1/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ PKM P14618 1/20 0.35
▸ ROCK2 O75116 1/20 0.35
▸ CDK1 P06493 1/20 0.35
▸ PRKACA P17612 1/20 0.35
▸ CDK2 P24941 1/20 0.35
▸ CSNK1D P48730 1/20 0.35
▸ GSK3A P49840 1/20 0.35

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
SCHEMBL30417443 1.00 KMT2A (0.43) KMT2ANPC1ALDH1A1KDM4EHPGD
SCHEMBL29008017 0.80 KMT2A (0.46) KMT2ANPC1ALDH1A1KDM4EHPGD
SCHEMBL30181185 0.80 KMT2A (0.46) KMT2ANPC1ALDH1A1KDM4EHPGD
SCHEMBL30417471 0.80 KMT2A (0.46) KMT2ANPC1ALDH1A1KDM4EHPGD
SCHEMBL30298033 0.78 NPC1 (0.53) KMT2ANPC1ALDH1A1KDM4EHPGD
SCHEMBL30181439 0.78 KMT2A (0.43) KMT2ANPC1ALDH1A1KDM4EHPGD
SCHEMBL29007756 0.78 ALDH1A1 (0.50) KMT2ANPC1ALDH1A1KDM4EHPGD
SCHEMBL30954825 0.78 NPC1 (0.54) KMT2ANPC1ALDH1A1KDM4EHPGD
SCHEMBL30954837 0.78 NPC1 (0.52) KMT2ANPC1ALDH1A1KDM4EHPGD
SCHEMBL30297948 0.78 NPC1 (0.54) KMT2ANPC1ALDH1A1KDM4EHPGD

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
EP-4114831-A1 COMPOUNDS TARGETING RNA-BINDING PROTEINS OR RNA-MODIFYING PROTEINS Twentyeight-Seven, Inc. (US) 2023-01-11 — — EP disclosed
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