SCHEMBL30687628

SCHEMBL30687628

CCN(CC)C(=O)c1ccc(N2CCN(Cc3cc(OC(F)(F)F)cc(-c4cccc(O)c4)c3)CC2)nn1

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ SLC6A9 P48067 2/20 0.36
▸ KCNH2 Q12809 2/20 0.36
▸ PPARG P37231 3/20 0.36
▸ PPARA Q07869 3/20 0.36
▸ PPARD Q03181 1/20 0.36
▸ CHRM3 P20309 1/20 0.36
▸ PANK3 Q9H999 2/20 0.36
▸ DRD2 P14416 2/20 0.36
▸ DRD4 P21917 2/20 0.36
▸ OPRM1 P35372 1/20 0.35
▸ OPRD1 P41143 1/20 0.35
▸ OPRK1 P41145 1/20 0.35
▸ PARP1 P09874 2/20 0.35
▸ PARP2 Q9UGN5 1/20 0.35
▸ DRD3 P35462 1/20 0.35
▸ MGLL Q99685 2/20 0.34
▸ DDR1 Q08345 2/20 0.34

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
SCHEMBL26682347 1.00 SLC6A9 (0.36) SLC6A9KCNH2PPARGPPARAPPARD
SCHEMBL26681093 0.92 SLC6A9 (0.39) SLC6A9KCNH2PPARGPPARAPPARD
SCHEMBL26680747 0.90 PPARG (0.37) PPARGPPARAPPARDPANK3DRD2
SCHEMBL30687749 0.90 PPARG (0.37) PPARGPPARAPPARDPANK3DRD2
SCHEMBL26682796 0.90 DRD2 (0.38) PPARGPPARACHRM3DRD2DRD4
SCHEMBL30687711 0.89 PPARG (0.39) PPARGPPARAPPARDCHRM3PANK3
SCHEMBL26680793 0.89 PPARG (0.39) PPARGPPARAPPARDCHRM3PANK3
SCHEMBL26683068 0.88 ALDH1A1 (0.36) DRD2DRD4OPRM1OPRD1OPRK1
SCHEMBL26681369 0.88 OPRM1 (0.40) PPARGPPARAPPARDOPRM1OPRD1
SCHEMBL30687681 0.87 PPARG (0.39) PPARGPPARAPPARDCHRM3PANK3

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
EP-4279476-A1 METHOD FOR ALKYLATING ACIDIC FUNCTIONAL GROUP CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2023-11-22 — — EP disclosed
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