SCHEMBL8426162

SCHEMBL8426162

N[C@@H](c1ccc(F)cc1)[C@@H](O)C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC3 O15379 1/20 0.41
HDAC4 P56524 1/20 0.41
HDAC1 Q13547 1/20 0.41
HDAC7 Q8WUI4 1/20 0.41
HDAC2 Q92769 1/20 0.41
HDAC10 Q969S8 1/20 0.41
HDAC11 Q96DB2 1/20 0.41
HDAC8 Q9BY41 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41
HDAC9 Q9UKV0 1/20 0.41
HDAC5 Q9UQL6 1/20 0.41
GRIK1 P39086 1/20 0.40
GRIK2 Q13002 1/20 0.40
SLC1A3 P43003 1/20 0.39
SLC1A2 P43004 1/20 0.39
SLC1A1 P43005 1/20 0.39
AOC3 Q16853 1/20 0.38
KDM4E B2RXH2 2/20 0.38
BLM P54132 2/20 0.38
PMP22 Q01453 2/20 0.38

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
SCHEMBL6512389 0.82 GRM8 (0.45) SLC1A3SLC1A2SLC1A1KDM4EBLM
SCHEMBL9261826 0.82 CYP2C9 (0.51) HDAC4HDAC7HDAC5GRIK1SLC1A3
SCHEMBL8058962 0.81 DPP4 (0.56) KDM4ELMNAMAPK1HIF1A
SCHEMBL939042 0.81 DPP4 (0.56) KDM4ELMNAMAPK1HIF1A
SCHEMBL487425 0.81 DPP4 (0.56) KDM4ELMNAMAPK1HIF1A
SCHEMBL4073511 0.81 DPP4 (0.56) KDM4ELMNAMAPK1HIF1A
SCHEMBL5860807 0.81 DPP4 (0.56) KDM4ELMNAMAPK1HIF1A
SCHEMBL939043 0.81 DPP4 (0.56) KDM4ELMNAMAPK1HIF1A
SCHEMBL9257685 0.80 LMNA (0.43) GRIK1GRIK2SLC1A3SLC1A2SLC1A1
SCHEMBL7618552 0.80 TPMT (0.40) KDM4EBLMPMP22LMNATSHR

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
US-5939561-A Process for the preparation of β-phenylisoserine and β-lactam and their analogues RHONE-POULENCE RORER S.A. (FR) 1999-08-17 US disclosed
US-5763628-A Process for the preparation of β-phenylisoserine and its analogues RHONE-POULENCE RORER S.A. (FR) 1998-06-09 US disclosed
US-5608102-A Process for the preparation of β-phenylisoserine and its analogues RHONE-POULENC RORER S.A. (FR) 1997-03-04 US disclosed
US-5476954-A Condensing hydroxyl protected taxane derivative with oxazolidine derivative, decyclizing in acid medium, reacting butoxycarbonyl or benzoyl radical with amine, deprotecting, isolating, purifying product RHONE-POULENC RORER S.A. (FR) 1995-12-19 US disclosed