SCHEMBL29277385

SCHEMBL29277385

N#CCn1cc(C=O)c2ccccc21

nearest known ligand 0.60

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 3/20 0.60
▸ KMT2A Q03164 3/20 0.60
▸ MEN1 O00255 2/20 0.60
▸ ALDH1A1 P00352 10/20 0.55
▸ SMN1; SMN2 Q16637 8/20 0.55
▸ HTT P42858 6/20 0.55
▸ LMNA P02545 4/20 0.52
▸ MAPT P10636 2/20 0.52
▸ NPC1 O15118 1/20 0.52
▸ HPGD P15428 1/20 0.52
▸ RAB9A P51151 1/20 0.52
▸ IMPDH2 P12268 1/20 0.51
▸ TDP1 Q9NUW8 2/20 0.51
▸ L3MBTL1 Q9Y468 1/20 0.49

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
SCHEMBL6851183 0.84 ALDH1A1 (0.57) POLBKMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL1784763 0.84 ALDH1A1 (0.64) POLBKMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL2189025 0.78 ALDH1A1 (0.59) POLBKMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL2187571 0.78 ALDH1A1 (0.63) POLBKMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL30512327 0.78 ALDH1A1 (0.62) POLBKMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL379309 0.78 ALDH1A1 (0.62) POLBKMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL27608925 0.78 ALDH1A1 (0.63) POLBKMT2AALDH1A1SMN1; SMN2HTT
SCHEMBL3153751 0.77 ALDH1A1 (0.69) POLBKMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL14519061 0.77 ALDH1A1 (0.71) POLBKMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL323912 0.77 KMT2A (0.59) POLBKMT2AMEN1ALDH1A1SMN1; SMN2

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-117285511-A Indole hybridized quinolone compound and preparation method and application thereof 西南大学 2023-12-26 — — CN disclosed
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