SCHEMBL5708152

SCHEMBL5708152

Cc1ccc(S(=O)(=O)N(Cc2ccc(F)cc2)C(=O)OC(C)(C)C)cc1

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TAS2R14 Q9NYV8 6/20 0.58
CNR1 P21554 2/20 0.52
CNR2 P34972 2/20 0.52
STAT5B P51692 2/20 0.50
LMNA P02545 1/20 0.49
TSHR P16473 1/20 0.49
HTT P42858 1/20 0.49
RECQL P46063 1/20 0.49
PTPN1 P18031 1/20 0.46
STAT3 P40763 1/20 0.45
EGFR P00533 1/20 0.44
ERBB2 P04626 1/20 0.44
POLB P06746 1/20 0.44
ATM Q13315 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44

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
SCHEMBL7702197 0.82 RIPK1 (0.43) TAS2R14
SCHEMBL7705112 0.80 STAT5B (0.46) TAS2R14CNR2STAT5BPTPN1STAT3
SCHEMBL12550326 0.78 STAT5B (0.52) TAS2R14CNR2STAT5B
SCHEMBL17661786 0.77 TAS2R14 (0.40) TAS2R14CNR1CNR2STAT5BLMNA
SCHEMBL12550044 0.77 STAT5B (0.49) TAS2R14STAT5BPTPN1
SCHEMBL7067656 0.76 STAT5B (0.44) TAS2R14CNR2STAT5BPTPN1STAT3
SCHEMBL5708145 0.76 C5AR1 (0.49) TAS2R14CNR1CNR2STAT5BSTAT3
SCHEMBL9181881 0.75 STAT5B (0.45) TAS2R14CNR2STAT5BPTPN1STAT3
SCHEMBL8879054 0.75 STAT5B (0.45) TAS2R14STAT5BLMNAPTPN1STAT3
SCHEMBL9986889 0.74 KMT2A (0.46) TAS2R14LMNATSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1419126-B1 FLUOROUS NUCLEOPHILIC SUBSTITUTION OF ALCOHOLS AND REAGENTS FOR USE THEREIN UNIV PITTSBURGH (US) 2006-11-02 EP disclosed
US-6806357-B1 REACTING THE ALCOHOL AND A NUCLEOPHILE WITH AN AZODICARBOXYLATE AND A PHOSPHINE. AT LEAST ONE OF THE AZODICARBOXYLATE AND THE PHOSPHINE INCLUDES AT LEAST ONE FLUOROUS TAG UNIVERSITY OF PITTSBURGH 2004-10-19 US disclosed