SCHEMBL11956919

SCHEMBL11956919

Cc1cn(CCO)c2cc(F)c(Cc3cccc(Cl)c3F)cc2c1=O

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ METTL3 Q86U44 1/20 0.43
▸ SLC22A12 Q96S37 5/20 0.41
▸ PKM P14618 1/20 0.35
▸ THRB P10828 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ MDM4 O15151 4/20 0.33
▸ MDM2 Q00987 4/20 0.33
▸ PCSK9 Q8NBP7 1/20 0.33
▸ P2RX7 Q99572 1/20 0.33
▸ CFD P00746 1/20 0.33

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
SCHEMBL13862215 0.86 ALDH1A1 (0.43) METTL3SLC22A12PKMMAPTPCSK9
SCHEMBL11948595 0.86 METTL3 (0.54) METTL3MAPT
SCHEMBL11948689 0.81 METTL3 (0.64) METTL3SLC22A12PKMTHRBMAPT
SCHEMBL11956954 0.81 METTL3 (0.49) METTL3SLC22A12PKMTHRBMAPT
SCHEMBL11957090 0.80 METTL3 (0.50) METTL3SLC22A12PKMTHRBCFD
SCHEMBL11956944 0.79 SLC22A12 (0.36) METTL3SLC22A12PKMTHRBMAPT
SCHEMBL1045220 0.78 METTL3 (0.46) METTL3MAPT
SCHEMBL1045948 0.78 METTL3 (0.54) METTL3MAPT
SCHEMBL1043831 0.76 METTL3 (0.53) METTL3MAPT
SCHEMBL1046027 0.76 METTL3 (0.71) METTL3MAPT

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8232401-B2 Useful as an anti-HIV agent that particularly shows an anti-HIV action based on an integrase inhibitory activity; for treatment or prophylaxis of AIDS; for example, 6-(2,3-dichlorobenzyl)-1-(2-hydroxyethyl)-4-oxo-1,4-dihydroquinoline-3-carboxylic acid JAPAN TOBACCO INC. (JP) 2012-07-31 — — US disclosed
US-7531554-B2 Useful as an anti-HIV agent that particularly shows an anti-HIV action based on an integrase inhibitory activity; for treatment or prophylaxis of AIDS; for example, 6-(2,3-dichlorobenzyl)-1-(2-hydroxyethyl)-4-oxo-1,4-dihydroquinoline-3-carboxylic acid JAPAN TOBACCO INC. (JP) 2009-05-12 — — US disclosed
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