SCHEMBL30612313

SCHEMBL30612313

COC(=O)c1ccccc1-c1cc[nH]c(=O)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ROCK2 O75116 1/20 0.59
▸ CSF1R P07333 1/20 0.59
▸ KDR P35968 1/20 0.59
▸ FLT3 P36888 1/20 0.59
▸ GSK3A P49840 1/20 0.59
▸ GSK3B P49841 1/20 0.59
▸ CDK5 Q00535 1/20 0.59
▸ ROCK1 Q13464 1/20 0.59
▸ SLK Q9H2G2 1/20 0.59
▸ IRAK4 Q9NWZ3 1/20 0.59
▸ SLC6A3 Q01959 4/20 0.58
▸ SLC6A4 P31645 3/20 0.58
▸ SLC6A2 P23975 1/20 0.58
▸ NOTUM Q6P988 1/20 0.47
▸ BTK Q06187 1/20 0.44
▸ LMNA P02545 1/20 0.44
▸ TSHR P16473 1/20 0.44
▸ MITF O75030 1/20 0.43
▸ MAPT P10636 1/20 0.43
▸ CHEK1 O14757 1/20 0.43

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
SCHEMBL29628231 0.86 SLC6A3 (0.46) ROCK2CSF1RKDRFLT3GSK3A
SCHEMBL15902337 0.80 BCAT2 (0.56) NOTUMBTKTSHRMAPTCHEK1
SCHEMBL30285287 0.79 SLC6A3 (0.71) ROCK2CSF1RKDRFLT3GSK3A
SCHEMBL30841297 0.79 SLC6A3 (0.66) ROCK2CSF1RKDRFLT3GSK3A
SCHEMBL9950445 0.76 CDK8 (0.59) NOTUMTSHR
SCHEMBL27843639 0.76 SLC6A3 (0.74) ROCK2CSF1RKDRFLT3GSK3A
SCHEMBL1775832 0.76 SLC6A3 (0.74) ROCK2CSF1RKDRFLT3GSK3A
SCHEMBL29891658 0.75 PTPRC (0.59) NOTUMCHEK1PTPRC
SCHEMBL69464 0.75 SLC6A3 (0.67) SLC6A3SLC6A4SLC6A2LMNATSHR
SCHEMBL2159619 0.75 SLC6A3 (0.60) ROCK2CSF1RKDRFLT3GSK3A

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
CN-116854631-B 4-Aryl-2-pyridone compound and preparation method thereof 安徽中医药大学 2025-04-15 — — CN disclosed
CN-116854631-A 4-aryl-2-pyridone compound and preparation method thereof 安徽中医药大学 2023-10-10 — — CN disclosed
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