SCHEMBL9575296

SCHEMBL9575296

O=C(c1ccccc1)C(O)(COS(=O)(=O)C(F)(F)F)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CES1 P23141 2/20 0.44
▸ SRC P12931 1/20 0.38
▸ PTPN1 P18031 2/20 0.38
▸ MAPK1 P28482 1/20 0.37
▸ HIF1A Q16665 1/20 0.37
▸ HSD11B1 P28845 2/20 0.35
▸ KAT6A Q92794 1/20 0.35
▸ CA2 P00918 3/20 0.35
▸ CA1 P00915 2/20 0.35
▸ CA5A P35218 1/20 0.35
▸ CA9 Q16790 1/20 0.35
▸ MLYCD O95822 1/20 0.35
▸ PRSS1 P07477 1/20 0.34
▸ CTSG P08311 1/20 0.34
▸ CTRB1 P17538 1/20 0.34
▸ CMA1 P23946 1/20 0.34
▸ POLB P06746 1/20 0.34
▸ NPSR1 Q6W5P4 1/20 0.34
▸ LMNA P02545 2/20 0.34
▸ RAB9A P51151 1/20 0.34

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
SCHEMBL9575059 0.83 CES1 (0.46) CES1SRCMAPK1HIF1APRSS1
Trifluoromethanesulfonic Acid SCHEMBL503620 0.77 CES1 (0.46) CES1SRCPTPN1MAPK1HSD11B1
SCHEMBL1635853 0.76 CES1 (0.40) CES1SRCPTPN1HSD11B1PRSS1
SCHEMBL547325 0.76 RECQL (0.46) CES1HSD11B1POLBNPSR1LMNA
SCHEMBL8399941 0.76 L3MBTL1 (0.43) CES1HSD11B1
SCHEMBL9718716 0.76 CES1 (0.56) CES1SRCMAPK1HIF1APRSS1
SCHEMBL507274 0.75 CA2 (0.42) PTPN1HSD11B1CA2CA1CA5A
SCHEMBL16820292 0.74 CES1 (0.46) CES1SRCMAPK1HIF1AMLYCD
SCHEMBL27798007 0.74 KDM4E (0.40) CES1PTPN1CA2CA1CA5A
SCHEMBL9575220 0.74 CES1 (0.40) CES1SRCPTPN1PRSS1CTSG

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-5190988-A Ultraviolet-curable organopolysiloxane composition containing a benzoinsulphonate initiator and metal catalyst SHIN-ETSU CHEMICAL COMPANY, LIMITED (JP) 1993-03-02 — — US disclosed
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