SCHEMBL8534248

SCHEMBL8534248

O=C(CC(O)CO)Nc1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 2/20 0.56
▸ LMNA P02545 1/20 0.56
▸ TSHR P16473 2/20 0.53
▸ EPHX2 P34913 2/20 0.52
▸ HDAC2 Q92769 3/20 0.50
▸ SLC1A3 P43003 1/20 0.49
▸ SLC1A2 P43004 1/20 0.49
▸ SLC1A1 P43005 1/20 0.49
▸ L3MBTL1 Q9Y468 2/20 0.49
▸ MAPT P10636 2/20 0.49
▸ HTT P42858 1/20 0.49
▸ HDAC3 O15379 2/20 0.47
▸ HDAC4 P56524 2/20 0.47
▸ HDAC1 Q13547 2/20 0.47
▸ HDAC7 Q8WUI4 2/20 0.47
▸ HDAC10 Q969S8 2/20 0.47
▸ HDAC11 Q96DB2 2/20 0.47
▸ HDAC8 Q9BY41 2/20 0.47
▸ HDAC6 Q9UBN7 2/20 0.47
▸ HDAC9 Q9UKV0 2/20 0.47

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
SCHEMBL9007944 0.82 PTPN1 (0.42) HPGDLMNATSHRHDAC2SLC1A3
SCHEMBL8893086 0.80 KLK7 (0.53) HPGDLMNAEPHX2MAPTHTT
SCHEMBL8563381 0.79 HPGD (0.62) HPGDLMNATSHREPHX2HDAC2
SCHEMBL5907668 0.79 HPGD (0.67) HPGDLMNATSHREPHX2HDAC2
SCHEMBL8008943 0.78 SMN1; SMN2 (0.55) HPGDLMNATSHREPHX2L3MBTL1
Acetanilide SCHEMBL8893082 0.78 NAPRT (0.70) L3MBTL1MAPTHTTALDH1A1GAA
SCHEMBL27846168 0.77 LMNA (0.51) HPGDLMNATSHREPHX2HDAC2
SCHEMBL6062563 0.77 LMNA (0.59) HPGDLMNATSHREPHX2SLC1A3
SCHEMBL3021548 0.77 LMNA (0.86) HPGDLMNATSHRHDAC2MAPT
SCHEMBL10404583 0.77 HPGD (0.59) HPGDLMNATSHREPHX2HDAC2

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
WO-2019196263-A1 METHOD FOR PREPARING HEXAHYDROFURO-FURANOL DERIVATIVE, INTERMEDIATE THEREOF AND PREPARATION METHOD THEREFOR 江苏瑞科医药科技有限公司 2019-10-17 — — WO disclosed
US-5728666-A PAINT STRIPPING FROM METALS; NONFLAMMABLE, BIODEGRADABLE, ODORLESS NAPIER INTERNATIONAL TECHNOLOGIES, INC. (CA) 1998-03-17 — — US disclosed
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