SCHEMBL7319840

SCHEMBL7319840

N[C@H](Cc1ccccc1)[C@H](O)c1ccco1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MIF P14174 1/20 0.51
SLC15A1 P46059 1/20 0.44
EPHX1 P07099 1/20 0.44
CSNK1E P49674 1/20 0.43
POLB P06746 2/20 0.42
KMT2A Q03164 2/20 0.42
MEN1 O00255 1/20 0.42
AGTR1 P30556 1/20 0.42
PKM P14618 3/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
GAA P10253 1/20 0.42
PTPN1 P18031 1/20 0.42
PTPN7 P35236 1/20 0.42
BLM P54132 1/20 0.42
ESR2 Q92731 1/20 0.42
ALPI P09923 1/20 0.42
PTGS1 P23219 1/20 0.42
XIAP P98170 1/20 0.42
SLC7A5 Q01650 1/20 0.42
CYP2C19 P33261 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
SCHEMBL7319842 1.00 MIF (0.51) MIFSLC15A1EPHX1CSNK1EPOLB
SCHEMBL7319847 1.00 MIF (0.51) MIFSLC15A1EPHX1CSNK1EPOLB
SCHEMBL7578243 0.80 MIF (0.59) MIFPOLBKMT2AMEN1AGTR1
SCHEMBL9764695 0.80 MIF (0.59) MIFPOLBKMT2AMEN1AGTR1
SCHEMBL3285388 0.78 MIF (0.53) MIFEPHX1POLBPKML3MBTL1
SCHEMBL27502071 0.76 EPHX1 (0.52) SLC15A1EPHX1CSNK1EPKMALPI
SCHEMBL22885996 0.74 LAP3 (0.40) SLC15A1EPHX1CSNK1EPKMALPI
SCHEMBL15272327 0.74 KMT2A (0.58) MIFPOLBKMT2AMEN1AGTR1
SCHEMBL15272598 0.74 KMT2A (0.58) MIFPOLBKMT2AMEN1AGTR1
SCHEMBL11151822 0.74 KMT2A (0.58) MIFPOLBKMT2AMEN1AGTR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5459131-A Renin inhibitors AMERICAN CYANAMID COMPANY (US) 1995-10-17 US disclosed