SCHEMBL7255372

SCHEMBL7255372

C[C@H](Oc1cc(C=O)ccc1OCc1ccc(OC(F)(F)F)cc1)c1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TACR2 P21452 1/20 0.44
RXRA P19793 1/20 0.41
RXRB P28702 1/20 0.41
RXRG P48443 1/20 0.41
ALDH1A1 P00352 5/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
AR P10275 2/20 0.40
MAPT P10636 2/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
MAOA P21397 1/20 0.39
MAOB P27338 1/20 0.39
RAB9A P51151 3/20 0.39
NPC1 O15118 2/20 0.39
TDP1 Q9NUW8 1/20 0.39
SLC6A4 P31645 1/20 0.39
HTT P42858 2/20 0.39
HPGD P15428 1/20 0.38
PPARG P37231 1/20 0.38
PPARA Q07869 1/20 0.38

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
SCHEMBL7259967 1.00 TACR2 (0.44) TACR2RXRARXRBRXRGALDH1A1
SCHEMBL7256181 1.00 TACR2 (0.44) TACR2RXRARXRBRXRGALDH1A1
SCHEMBL7259006 1.00 TACR2 (0.44) TACR2RXRARXRBRXRGALDH1A1
SCHEMBL7255337 0.87 ALDH1A1 (0.45) TACR2ALDH1A1SMN1; SMN2MAPTMEN1
SCHEMBL7255339 0.87 TACR2 (0.42) TACR2RXRARXRBRXRGALDH1A1
SCHEMBL5217929 0.86 TACR2 (0.52) TACR2RXRARXRBRXRGALDH1A1
SCHEMBL7255761 0.84 RXRA (0.43) RXRARXRBRXRGRAB9ANPC1
SCHEMBL7258851 0.84 RXRA (0.43) RXRARXRBRXRGRAB9ANPC1
SCHEMBL6688720 0.81 ALDH1A1 (0.58) TACR2ALDH1A1SMN1; SMN2MAPTMEN1
SCHEMBL7259002 0.81 RXRA (0.47) RXRARXRBRXRGSMN1; SMN2MAPT

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
WO-2003070238-A1 THIAZOLIDINE ANTIFUNGAL AGENTS OXFORD GLYCOSCIENCES (UK) LTD (GB) 2003-08-28 WO claimed
WO-2003070238-A1 THIAZOLIDINE ANTIFUNGAL AGENTS OXFORD GLYCOSCIENCES (UK) LTD (GB) 2003-08-28 WO disclosed