SCHEMBL29283849

SCHEMBL29283849

O=c1c2ccc(-c3ccccc3F)cc2ccn1Cc1ccccc1F

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ THRB P10828 1/20 0.45
▸ LMNA P02545 6/20 0.43
▸ TP53 P04637 2/20 0.43
▸ POLB P06746 1/20 0.43
▸ MKNK1 Q9BUB5 2/20 0.41
▸ MKNK2 Q9HBH9 2/20 0.41
▸ HSP90AB1 P08238 1/20 0.41
▸ PTPRC P08575 1/20 0.40
▸ PTPN1 P18031 1/20 0.40
▸ ALDH1A1 P00352 3/20 0.40
▸ KDM4E B2RXH2 2/20 0.40
▸ GRM2 Q14416 1/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ TNKS O95271 1/20 0.40
▸ TNKS2 Q9H2K2 1/20 0.40
▸ MAPT P10636 1/20 0.39
▸ RXFP1 Q9HBX9 1/20 0.38
▸ CA12 O43570 1/20 0.38
▸ HPGD P15428 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
SCHEMBL31006562 0.91 THRB (0.42) THRBLMNATP53POLBMKNK1
SCHEMBL29283803 0.91 THRB (0.42) THRBLMNATP53POLBMKNK1
SCHEMBL31006542 0.89 HSP90AB1 (0.46) THRBLMNATP53POLBMKNK1
SCHEMBL29283860 0.89 HSP90AB1 (0.46) THRBLMNATP53POLBMKNK1
SCHEMBL29283824 0.89 THRB (0.40) THRBLMNATP53POLBMKNK1
SCHEMBL31006521 0.89 THRB (0.40) THRBLMNATP53POLBMKNK1
SCHEMBL31006544 0.88 LMNA (0.46) THRBLMNAPOLBPTPRCPTPN1
SCHEMBL31006561 0.88 HIF1A (0.40) THRBLMNATP53POLBMKNK1
SCHEMBL29283854 0.88 HIF1A (0.40) THRBLMNATP53POLBMKNK1
SCHEMBL29283799 0.88 LMNA (0.46) THRBLMNAPOLBPTPRCPTPN1

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-118184635-A Quinolinone compound, pharmaceutical composition and application thereof 安徽医科大学 2024-06-14 — — CN disclosed
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