SCHEMBL7066151

SCHEMBL7066151

O=C(OCCc1ccccc1)C(CCOS(=O)(=O)c1ccccc1[N+](=O)[O-])OS(=O)(=O)c1ccccc1[N+](=O)[O-]

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.40
MEN1 O00255 2/20 0.40
LMNA P02545 1/20 0.38
MAPT P10636 1/20 0.38
THRB P10828 1/20 0.38
NTSR1 P30989 1/20 0.38
HTT P42858 1/20 0.38
F2 P00734 2/20 0.38
PRSS1 P07477 2/20 0.38
PRSS2 P07478 2/20 0.38
PRSS3 P35030 2/20 0.38
AR P10275 1/20 0.38
GAA P10253 1/20 0.37
RAB9A P51151 1/20 0.37
CYP19A1 P11511 1/20 0.37
PTPN1 P18031 2/20 0.37
POLB P06746 2/20 0.37
ALDH1A1 P00352 2/20 0.37
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37

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
SCHEMBL7976215 0.94 KMT2A (0.38) KMT2AMEN1LMNAMAPTTHRB
SCHEMBL7959963 0.93 L3MBTL1 (0.38) KMT2AMEN1LMNAMAPTTHRB
SCHEMBL7067318 0.90 AR (0.43) KMT2AMEN1LMNAMAPTTHRB
SCHEMBL7065771 0.86 L3MBTL1 (0.47) KMT2AMEN1THRBF2PRSS1
SCHEMBL7062439 0.85 L3MBTL1 (0.40) KMT2AMEN1LMNAMAPTTHRB
SCHEMBL7064585 0.85 KMT2A (0.40) KMT2AMEN1MAPTTHRBHTT
SCHEMBL7062455 0.84 ALDH1A1 (0.46) KMT2AMEN1LMNATHRBF2
SCHEMBL7976152 0.84 AR (0.41) KMT2AMEN1LMNAMAPTTHRB
SCHEMBL7970022 0.83 AR (0.41) KMT2AMEN1LMNAMAPTTHRB
SCHEMBL7064348 0.83 L3MBTL1 (0.43) KMT2AMEN1LMNAMAPTTHRB

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
EP-0827954-B1 Process for producing optically active azetidine-2-carboxylic acid SUMITOMO CHEMICAL CO (JP) 2003-06-04 EP disclosed
US-6114543-A Process for producing optically active azetidine-2-carboxylic acid SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2000-09-05 US disclosed
US-5880291-A Process for producing optically active azetidine-2-carboxylic acid SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1999-03-09 US disclosed
EP-0827954-A1 Process for producing optically active azetidine-2-carboxylic acid SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1998-03-11 EP disclosed