SCHEMBL7252888

SCHEMBL7252888

O=C([AsH]c1ccc(OCCOc2c(F)ccc(F)c2F)cc1C(=O)O)c1ccc(Cl)cc1Cl

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.39
CASP1 P29466 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
MRGPRX4 Q96LA9 2/20 0.38
ATM Q13315 1/20 0.37
CXCR2 P25025 1/20 0.37
NPC1 O15118 1/20 0.37
HTT P42858 1/20 0.36
RECQL P46063 1/20 0.36
PPARG P37231 3/20 0.36
PPARA Q07869 1/20 0.36
PLA2G4A P47712 2/20 0.35
RARA P10276 1/20 0.35
RARB P10826 1/20 0.35
PRKAB2 O43741 1/20 0.35
PRKAG1 P54619 1/20 0.35
PRKAA2 P54646 1/20 0.35
PRKAA1 Q13131 1/20 0.35
PRKAG3 Q9UGI9 1/20 0.35
PRKAG2 Q9UGJ0 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
SCHEMBL7038535 0.80 PPARG (0.58) ATMNPC1PPARGPPARA
SCHEMBL7034794 0.79 PPARG (0.57) ATMNPC1PPARGPPARA
Lithium Ion SCHEMBL7034789 0.73 PPARG (0.68) ATMNPC1PPARGPPARA
SCHEMBL7036795 0.73 PPARG (0.55) ATMNPC1HTTRECQLPPARG
SCHEMBL7252878 0.68 PPARG (0.61) TSHRCASP1SMN1; SMN2HTTPPARG
SCHEMBL7252882 0.68 PPARG (0.61) TSHRCASP1SMN1; SMN2HTTPPARG
SCHEMBL7252441 0.65 PPARG (0.53) TSHRCASP1SMN1; SMN2NPC1RECQL
SCHEMBL29712519 0.64 ALDH1A1 (0.58) TSHRRARARARBPPARD
SCHEMBL5063442 0.64 SMN1; SMN2 (0.49) TSHRCASP1SMN1; SMN2ATMNPC1
SCHEMBL8067440 0.62 MAPT (0.58) TSHRSMN1; SMN2MRGPRX4MAOAMAOB

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
WO-2003004458-A1 NEW COMPOUNDS BIOVITRUM AB (SE) 2003-01-16 WO claimed