SCHEMBL7340340

SCHEMBL7340340

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

nearest known ligand 0.45

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
FDPS P14324 1/20 0.45
PTPN1 P18031 12/20 0.43
PTPRC P08575 2/20 0.40
PGK1 P00558 2/20 0.36
PGK2 P07205 2/20 0.36
CES1 P23141 1/20 0.36
TSHR P16473 1/20 0.36

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 0.91 FDPS (0.50) FDPSPTPN1PTPRCPGK1PGK2
SCHEMBL698715 0.81 LPAR1 (0.37) FDPS
SCHEMBL7333271 0.78 FDPS (0.43) FDPSPTPN1PTPRCPGK1PGK2
SCHEMBL6828589 0.75 KMT2A (0.45) FDPSPTPN1TSHR
SCHEMBL6741779 0.72 PPARG (0.51) PTPN1CES1TSHR
SCHEMBL16754032 0.72 PPARG (0.51) PTPN1CES1TSHR
SCHEMBL5324671 0.70 LMNA (0.44) FDPSPTPN1
SCHEMBL7263779 0.70 FDPS (0.58) FDPSPTPN1PTPRCTSHR
SCHEMBL9849577 0.70 FDPS (0.58) FDPSPTPN1PTPRCPGK1PGK2
Aniline SCHEMBL2334841 0.69 SLC6A2 (0.42) CES1TSHR

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