SCHEMBL9269080

SCHEMBL9269080

CCCCCCCN(C(=O)Nc1ccc(F)cc1F)C1CCC(C2CCCCC2)CC1

nearest known ligand 0.53

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 4/20 0.53
▸ PPARA Q07869 4/20 0.53
▸ PPARD Q03181 2/20 0.53
▸ SOAT1 P35610 2/20 0.50
▸ NPC1 O15118 1/20 0.45
▸ POLB P06746 1/20 0.45
▸ RAB9A P51151 1/20 0.45
▸ HTT P42858 2/20 0.44
▸ SOAT2 O75908 1/20 0.44

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
SCHEMBL9269084 1.00 PPARG (0.53) PPARGPPARAPPARDSOAT1NPC1
SCHEMBL1448948 0.81 PPARG (0.49) PPARGPPARAPPARDSOAT1HTT
Hydrochloric Acid SCHEMBL841464 0.81 PPARG (0.49) PPARGPPARAPPARDSOAT1HTT
SCHEMBL9260551 0.80 PPARG (0.67) PPARGPPARAPPARDSOAT1NPC1
SCHEMBL9270367 0.80 UBE2M (0.52) PPARGPPARAPPARDNPC1POLB
SCHEMBL9270364 0.80 UBE2M (0.52) PPARGPPARAPPARDNPC1POLB
SCHEMBL9269044 0.79 SOAT1 (0.46) PPARGPPARAPPARDSOAT1SOAT2
SCHEMBL27266162 0.79 PPARG (0.57) PPARGPPARAPPARDNPC1POLB
SCHEMBL9269480 0.77 CYP3A4 (0.44) POLB
SCHEMBL9269474 0.77 CYP3A4 (0.44) POLB

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-5420164-A Enzyme inhibitors YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1995-05-30 — — US disclosed
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