SCHEMBL7333271

SCHEMBL7333271

CC(C)C(Cc1ccccc1)(OS(=O)(=O)C(F)(F)F)P(=O)(O)O

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FDPS P14324 2/20 0.43
PTPN1 P18031 12/20 0.41
PTPRC P08575 2/20 0.39
MEN1 O00255 1/20 0.35
CYP1A2 P05177 1/20 0.35
KMT2A Q03164 1/20 0.35
TSHR P16473 1/20 0.35
TRPA1 O75762 1/20 0.35
PGK1 P00558 1/20 0.35
PGK2 P07205 1/20 0.35

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
SCHEMBL7334079 0.80 FDPS (0.50) FDPSPTPN1PTPRCTSHRPGK1
SCHEMBL7340340 0.78 FDPS (0.45) FDPSPTPN1PTPRCTSHRPGK1
SCHEMBL21822083 0.77 FDPS (0.47) FDPSPTPN1MEN1CYP1A2KMT2A
SCHEMBL6741779 0.70 PPARG (0.51) PTPN1CYP1A2TSHR
SCHEMBL16754032 0.70 PPARG (0.51) PTPN1CYP1A2TSHR
SCHEMBL10626908 0.70 FDPS (0.61) FDPSPTPN1MEN1CYP1A2KMT2A
SCHEMBL7603206 0.68 FDPS (0.59) FDPSPTPN1CYP1A2TSHRTRPA1
SCHEMBL4098286 0.68 PTPN5 (0.32)
SCHEMBL9849577 0.68 FDPS (0.58) FDPSPTPN1PTPRCPGK1PGK2
SCHEMBL7340346 0.68 LAP3 (0.42) MEN1CYP1A2KMT2ATRPA1

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-5952327-A NEUTRAL ENDOPEPTIDASE INHIBITORS; TREATMENT OF CARDIOVASCULAR DISORDERS SOLVAY PHARMACEUTICALS GMBH (DE) 1999-09-14 US disclosed