SCHEMBL30719598

SCHEMBL30719598

Cc1cc(-c2ccc(N)c3ccccc23)ccc1O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HDAC3 O15379 1/20 0.53
▸ IDO1 P14902 1/20 0.53
▸ EP300 Q09472 1/20 0.53
▸ KAT2B Q92831 1/20 0.53
▸ KAT8 Q9H7Z6 1/20 0.53
▸ NCOR2 Q9Y618 1/20 0.53
▸ TLR8 Q9NR97 4/20 0.51
▸ PKM P14618 1/20 0.47
▸ HSD17B1 P14061 5/20 0.45
▸ HSD17B2 P37059 5/20 0.45
▸ PDE10A Q9Y233 1/20 0.44
▸ ESR2 Q92731 2/20 0.44
▸ ALDH1A1 P00352 2/20 0.42
▸ CYP3A4 P08684 2/20 0.42
▸ TSHR P16473 1/20 0.42
▸ TDP1 Q9NUW8 1/20 0.42
▸ ESR1 P03372 1/20 0.41
▸ AR P10275 1/20 0.41
▸ KDM4E B2RXH2 1/20 0.41
▸ MEN1 O00255 1/20 0.41

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
SCHEMBL23496971 1.00 HDAC3 (0.53) HDAC3IDO1EP300KAT2BKAT8
SCHEMBL30719597 1.00 HDAC3 (0.53) HDAC3IDO1EP300KAT2BKAT8
SCHEMBL30719600 0.86 TLR8 (0.57) IDO1TLR8HSD17B1HSD17B2ESR2
SCHEMBL23496970 0.86 TLR8 (0.57) IDO1TLR8HSD17B1HSD17B2ESR2
SCHEMBL13678995 0.82 TLR8 (0.70) TLR8HSD17B1HSD17B2ESR2CYP3A4
SCHEMBL30719615 0.78 TLR8 (0.74) TLR8HSD17B1HSD17B2ESR2CYP3A4
SCHEMBL22078735 0.78 TLR8 (0.74) TLR8HSD17B1HSD17B2ESR2CYP3A4
SCHEMBL23496933 0.78 TLR8 (0.52) IDO1EP300KAT8TLR8HSD17B1
SCHEMBL30719599 0.78 TLR8 (0.52) IDO1EP300KAT8TLR8HSD17B1
SCHEMBL14417224 0.77 IDO1 (0.48) HDAC3IDO1EP300KAT2BKAT8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117586191-A TOLL-like receptor 8 (TLR 8) specific antagonists, methods of making and uses thereof 科罗拉多州立大学董事会法人团体 2024-02-23 — — CN disclosed
CN-117586108-A TOLL-like receptor 8 (TLR 8) specific antagonists, methods of making and uses thereof 科罗拉多州立大学董事会法人团体 2024-02-23 — — CN disclosed
CN-111542515-B TOLL-like receptor 8 (TLR 8) specific antagonists, methods of making and uses thereof 科罗拉多州立大学董事会法人团体 2023-12-05 — — CN disclosed
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