SCHEMBL28796630

SCHEMBL28796630

O=C(c1ccccc1)c1c(-c2ccccc2)c(-n2ccccc2=O)c2ccccn12

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ HTT P42858 2/20 0.45
▸ FNTA P49354 1/20 0.40
▸ FNTB P49356 1/20 0.40
▸ KMT2A Q03164 4/20 0.38
▸ MEN1 O00255 3/20 0.38
▸ ALDH1A1 P00352 3/20 0.38
▸ RXFP1 Q9HBX9 1/20 0.38
▸ HPGD P15428 1/20 0.38
▸ NPSR1 Q6W5P4 1/20 0.38
▸ PTGS2 P35354 1/20 0.38
▸ MAPT P10636 4/20 0.37
▸ GAA P10253 2/20 0.37
▸ CYP1A2 P05177 1/20 0.37
▸ CYP3A4 P08684 1/20 0.37
▸ CYP2D6 P10635 1/20 0.37
▸ CYP2C9 P11712 1/20 0.37
▸ CYP2C19 P33261 1/20 0.37
▸ TP53 P04637 1/20 0.37
▸ LMNA P02545 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
SCHEMBL29635286 0.95 HTT (0.41) HTTFNTAFNTBKMT2AMEN1
SCHEMBL29140074 0.88 KMT2A (0.48) HTTFNTAFNTBKMT2AMEN1
SCHEMBL29635285 0.88 HTT (0.42) HTTKMT2AMEN1ALDH1A1MAPT
SCHEMBL29635290 0.88 MAPT (0.44) HTTFNTAFNTBKMT2AMEN1
SCHEMBL28796566 0.85 KMT2A (0.43) HTTKMT2AMEN1MAPT
SCHEMBL29635289 0.85 MAPT (0.50) KMT2AALDH1A1HPGDMAPTGAA
SCHEMBL29635288 0.84 MAPT (0.46) KMT2AMEN1ALDH1A1MAPTGAA
SCHEMBL29635284 0.84 CNR2 (0.41) HTTALDH1A1HPGDNPSR1MAPT
SCHEMBL29635287 0.76 MEN1 (0.50) HTTKMT2AMEN1ALDH1A1HPGD
SCHEMBL29140110 0.76 ALDH1A1 (0.43) HTTKMT2AMEN1ALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114671868-B Polysubstituted indolizine compound containing pyridone and preparation method and application thereof 浙大城市学院 2023-03-31 — — CN claimed
CN-114671868-A Polysubstituted indolizine compound containing pyridone and preparation method and application thereof 浙大城市学院 2022-06-28 — — CN claimed
CN-114671868-B Polysubstituted indolizine compound containing pyridone and preparation method and application thereof 浙大城市学院 2023-03-31 — — CN disclosed
CN-114671868-A Polysubstituted indolizine compound containing pyridone and preparation method and application thereof 浙大城市学院 2022-06-28 — — CN disclosed
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