SCHEMBL6247277

SCHEMBL6247277

O=C(O)c1sc(-c2cccc(C(F)(F)F)c2)nc1CO

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.70
▸ SMN1; SMN2 Q16637 3/20 0.70
▸ MEN1 O00255 3/20 0.58
▸ KMT2A Q03164 3/20 0.58
▸ MAPT P10636 3/20 0.58
▸ KDM4E B2RXH2 1/20 0.47
▸ XDH P47989 1/20 0.47
▸ PPARA Q07869 3/20 0.46
▸ KMO O15229 2/20 0.46
▸ NPC1 O15118 1/20 0.45
▸ HPGD P15428 1/20 0.45
▸ RAB9A P51151 1/20 0.45
▸ ALPL P05186 1/20 0.45
▸ ALPI P09923 1/20 0.45
▸ PIN1 Q13526 1/20 0.44
▸ PPARG P37231 2/20 0.43
▸ PPARD Q03181 1/20 0.43
▸ RXRA P19793 1/20 0.43
▸ RXRB P28702 1/20 0.43
▸ RXRG P48443 1/20 0.43

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
SCHEMBL5899944 0.84 KDM4E (0.55) ALDH1A1SMN1; SMN2MEN1KMT2AMAPT
SCHEMBL979633 0.82 ALDH1A1 (1.00) ALDH1A1SMN1; SMN2MEN1KMT2AMAPT
SCHEMBL13650688 0.82 ALDH1A1 (0.51) ALDH1A1SMN1; SMN2MEN1KMT2AMAPT
SCHEMBL1198088 0.81 ALDH1A1 (0.50) ALDH1A1SMN1; SMN2MEN1KMT2AMAPT
SCHEMBL1199289 0.81 ALDH1A1 (0.56) ALDH1A1SMN1; SMN2MEN1KMT2AMAPT
SCHEMBL1198661 0.80 MEN1 (0.49) ALDH1A1SMN1; SMN2MEN1KMT2AMAPT
SCHEMBL1198261 0.79 MEN1 (0.54) ALDH1A1SMN1; SMN2MEN1KMT2AMAPT
SCHEMBL16399145 0.77 MEN1 (0.52) ALDH1A1SMN1; SMN2MEN1KMT2AMAPT
SCHEMBL1198708 0.77 MEN1 (0.47) ALDH1A1SMN1; SMN2MEN1KMT2AMAPT
SCHEMBL6756856 0.76 MAPT (0.75) ALDH1A1SMN1; SMN2MEN1KMT2AMAPT

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-1534280-A1 ARYL PIPERIDINE DERIVATIVES AND USE THEREOF TO REDUCE ELEVATED LEVELS OF LDL-CHOLESTEROL GLAXO GROUP LIMITED (GB) 2005-06-01 — — EP disclosed
WO-2004006924-A1 ARYL PIPERIDINE DERIVATIVES AND USE THEREOF TO REDUCE ELEVATED LEVELS OF LDL-CHOLESTEROL GLAXO GROUP LIMITED (GB) 2004-01-22 — — WO disclosed
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