SCHEMBL28090496

SCHEMBL28090496

O=C1C=CC(=O)N1c1ccsc1

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 15/20 0.54
FAAH O00519 6/20 0.54
HSP90AA1 P07900 3/20 0.45
TDP1 Q9NUW8 2/20 0.45
BCHE P06276 1/20 0.45
PKM P14618 1/20 0.45
MAPK1 P28482 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
DDAH1 O94760 1/20 0.41
CCR6 P51684 2/20 0.40
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.39
CACNA1B Q00975 1/20 0.39
APBA1 Q02410 1/20 0.39
APOBEC3G Q9HC16 1/20 0.39

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
SCHEMBL17047745 0.74 PARP1 (0.40) PKMMAPK1ALDH1A1
SCHEMBL8980795 0.72 KMT2A (0.50)
SCHEMBL95324 0.72 MGLL (1.00) MGLLFAAHHSP90AA1TDP1BCHE
SCHEMBL6344199 0.71 TLR9 (0.40) MGLLFAAHALDH1A1
SCHEMBL600517 0.70 CYP2A6 (0.33) PKM
SCHEMBL27759405 0.70 TLR9 (0.34) MGLLPKMMAPK1ALDH1A1
SCHEMBL21478341 0.70 MEN1 (0.38) PKMMAPK1NPSR1ALDH1A1
SCHEMBL9132838 0.67 MGLL (1.00) MGLLFAAHHSP90AA1TDP1BCHE
SCHEMBL915633 0.66 CES1 (0.64) BCHENPSR1ALDH1A1
SCHEMBL8641616 0.66 MGLL (0.70) MGLLFAAHHSP90AA1TDP1BCHE

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-119431745-A Method for preparing macromer and macromer prepared thereby 百进生物科技公司 2025-02-14 CN disclosed
CN-111032823-B Conjugated polymers and methods of use thereof 百进生物科技公司 2024-12-20 CN disclosed
CN-105122137-B Photosensitive resin composition, protective film or insulating film, touch panel, and method for producing same 东丽株式会社 2020-02-07 CN disclosed
CN-105949108-A Preparation method of 3-(4-methoxyphenylthio)-1-methyl-1H-pyrrolyl-2,5-dione compound 东华大学 2016-09-21 CN disclosed