SCHEMBL4039591

SCHEMBL4039591

C#CC(=O)C(C)Cc1ccc(Cl)cc1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ SLC6A2 P23975 1/20 0.47
▸ SLC6A3 Q01959 1/20 0.47
▸ ACACB O00763 1/20 0.47
▸ PPARG P37231 3/20 0.41
▸ PPARA Q07869 3/20 0.41
▸ SLC6A4 P31645 1/20 0.41
▸ POLB P06746 1/20 0.40
▸ CTSC P53634 1/20 0.40
▸ FPR2 P25090 1/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ RAB9A P51151 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ GAA P10253 1/20 0.39
▸ MC4R P32245 2/20 0.38
▸ MAOB P27338 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
SCHEMBL4043564 0.83 MAOA (0.47) PPARAKMT2AMAOB
SCHEMBL4040112 0.80 LDHA (0.56) ACACBPPARGPPARASLC6A4POLB
SCHEMBL11145872 0.78 SLC6A2 (0.53) SLC6A2SLC6A3ACACBPPARGPPARA
SCHEMBL13235901 0.78 SLC6A2 (0.53) SLC6A2SLC6A3ACACBPPARGPPARA
SCHEMBL4666674 0.78 PPARG (0.54) SLC6A2SLC6A3ACACBPPARGPPARA
SCHEMBL2555902 0.78 PPARG (0.54) SLC6A2SLC6A3ACACBPPARGPPARA
SCHEMBL4666677 0.78 PPARG (0.54) SLC6A2SLC6A3ACACBPPARGPPARA
SCHEMBL11242882 0.78 SLC6A2 (0.53) SLC6A2SLC6A3ACACBPPARGPPARA
SCHEMBL9875052 0.77 SLC6A2 (0.52) SLC6A2SLC6A3ACACBPPARGPPARA
SCHEMBL27343062 0.75 SLC6A2 (0.50) SLC6A2SLC6A3ACACBPPARGPPARA

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-2038279-A2 SUBSTITUTED PYRAZOLO [1,5- ALPHA] PYRIDINE COMPOUNDS AND THEIR METHODS OF USE Avigen, Inc. (US) 2009-03-25 — — EP disclosed
WO-2007146087-A2 SUBSTITUTED PYRAZOLO [1,5-α] PYRIDINE COMPOUNDS AND THEIR METHODS OF USE AVIGEN, INC. (US) 2007-12-21 — — WO disclosed
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