SCHEMBL29202845

SCHEMBL29202845

Cn1c2c(c3ccccc31)CCCC2C(=O)C1CCCc2c1n(C)c1ccccc21

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ HSD17B10 Q99714 3/20 0.56
▸ USP2 O75604 1/20 0.56
▸ TBXA2R P21731 1/20 0.45
▸ PTGDR Q13258 1/20 0.45
▸ SIRT2 Q8IXJ6 2/20 0.43
▸ SIRT1 Q96EB6 2/20 0.43
▸ ALDH1A1 P00352 2/20 0.43
▸ KDM4E B2RXH2 2/20 0.43
▸ MEN1 O00255 2/20 0.42
▸ KMT2A Q03164 2/20 0.42
▸ HPGD P15428 1/20 0.42
▸ GLA P06280 1/20 0.42
▸ CASP1 P29466 1/20 0.42
▸ CASP7 P55210 1/20 0.42

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
SCHEMBL28328665 0.78 HSD17B10 (0.45) HSD17B10USP2ALDH1A1KDM4EMEN1
SCHEMBL28992040 0.77 HSD17B10 (0.42) HSD17B10USP2TBXA2RPTGDRALDH1A1
SCHEMBL4041356 0.75 HSD17B10 (0.43) HSD17B10USP2ALDH1A1KDM4EMEN1
SCHEMBL1875327 0.73 HSD17B10 (0.80) HSD17B10USP2SIRT2SIRT1ALDH1A1
SCHEMBL16266114 0.72 HSD17B10 (1.00) HSD17B10USP2SIRT2SIRT1ALDH1A1
SCHEMBL8793251 0.71 HTR2A (0.44) HSD17B10USP2ALDH1A1KDM4EMEN1
SCHEMBL10577890 0.70 SLC6A4 (0.43) HSD17B10ALDH1A1KDM4EMEN1KMT2A
SCHEMBL10577899 0.70 SLC6A4 (0.43) HSD17B10ALDH1A1KDM4EMEN1KMT2A
SCHEMBL10577896 0.70 SLC6A4 (0.43) HSD17B10ALDH1A1KDM4EMEN1KMT2A
Hydrochloric Acid SCHEMBL8792855 0.70 ALOX15 (0.45) HSD17B10ALDH1A1KDM4EMEN1KMT2A

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-115677561-B 1,2,3, 4-tetrahydro-9-methyl-4H-carbazolone and synthesis method thereof 常州兰陵制药有限公司 2024-04-05 — — CN claimed
CN-115677561-B 1,2,3, 4-tetrahydro-9-methyl-4H-carbazolone and synthesis method thereof 常州兰陵制药有限公司 2024-04-05 — — CN disclosed
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