SCHEMBL11818108

SCHEMBL11818108

O=C(O)c1cc(OC(F)(F)F)cc(SCc2ccc(S(=O)(=O)C(F)(F)F)cc2)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTPRZ1 P23471 1/20 0.40
▸ BCHE P06276 1/20 0.40
▸ ACHE P22303 1/20 0.40
▸ MEP1B Q16820 1/20 0.39
▸ TRPM8 Q7Z2W7 7/20 0.38
▸ WDR5 P61964 1/20 0.38
▸ CA12 O43570 2/20 0.38
▸ CA1 P00915 2/20 0.38
▸ CA2 P00918 2/20 0.38
▸ CA9 Q16790 2/20 0.38
▸ MMP2 P08253 2/20 0.38
▸ MMP9 P14780 2/20 0.38
▸ PPARA Q07869 1/20 0.38
▸ MRGPRX4 Q96LA9 1/20 0.37
▸ AURKA O14965 1/20 0.37
▸ TPX2 Q9ULW0 1/20 0.37
▸ CA3 P07451 1/20 0.36
▸ CA4 P22748 1/20 0.36
▸ CA6 P23280 1/20 0.36
▸ CA5A P35218 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
SCHEMBL11818815 0.88 MRGPRX4 (0.42) BCHEACHEMEP1BTRPM8WDR5
SCHEMBL11820243 0.85 MRGPRX4 (0.48) MEP1BPPARAMRGPRX4AURKATPX2
SCHEMBL11818392 0.80 TSHR (0.43) PTPRZ1MEP1BTRPM8WDR5MMP2
SCHEMBL11823334 0.79 MCL1 (0.44) MEN1LMNAPOLBHPGDRAB9A
SCHEMBL11820784 0.77 MEP1B (0.41) PTPRZ1MEP1BTRPM8WDR5MMP2
SCHEMBL11810807 0.77 ALDH1A1 (0.41) BCHEACHEMMP2MMP9MEN1
SCHEMBL24017232 0.76 AURKA (0.44) MEP1BTRPM8WDR5CA1CA2
SCHEMBL11815385 0.76 MRGPRX4 (0.46) MEP1BPPARAMRGPRX4AURKATPX2
SCHEMBL11820227 0.74 TRPV1 (0.46) PPARAMRGPRX4AURKATPX2MEN1
SCHEMBL11817074 0.73 DAO (0.41) PPARAMRGPRX4AURKATPX2HPGD

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-3954994-A Intermediates for preparing hipolipemic agents and method of lowering the blood lipid level in mammals with said agents PFIZER INC. (US) 1976-05-04 — — US disclosed
Send feedback