SCHEMBL27884355

SCHEMBL27884355

O=C(O)c1ccc(Cc2cc3cc(Cl)ccc3n2S(=O)(=O)CC=Cc2ccc3ccccc3c2)cc1

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 5/20 0.44
▸ PTPN1 P18031 2/20 0.41
▸ ACP1 P24666 2/20 0.41
▸ PPARA Q07869 4/20 0.40
▸ PPARD Q03181 2/20 0.40
▸ ACLY P53396 6/20 0.39
▸ DHCR7 Q9UBM7 1/20 0.39
▸ EBP Q15125 1/20 0.38
▸ SIGMAR1 Q99720 1/20 0.38
▸ CCR2 P41597 1/20 0.35
▸ GRIK1 P39086 1/20 0.35
▸ GRIK2 Q13002 1/20 0.35
▸ GRIK3 Q13003 1/20 0.35
▸ PLA2G4A P47712 1/20 0.35

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
SCHEMBL28797215 0.88 DHCR7 (0.41) PPARGPPARAPPARDACLYDHCR7
SCHEMBL27884364 0.88 DHCR7 (0.42) PPARGPPARAPPARDACLYDHCR7
SCHEMBL27884197 0.87 PTPN1 (0.43) PPARGPTPN1ACP1PPARAPPARD
SCHEMBL27867728 0.87 ACLY (0.39) PPARGPPARAPPARDACLYDHCR7
SCHEMBL27884471 0.86 ACLY (0.37) PPARGPPARAPPARDACLYDHCR7
SCHEMBL27867758 0.86 ACLY (0.38) PPARGPPARAPPARDACLYDHCR7
SCHEMBL27867768 0.85 P2RX3 (0.39) PPARGPPARAPPARDACLYDHCR7
SCHEMBL27713685 0.84 PPARG (0.59) PPARGPPARAPPARD
SCHEMBL27733709 0.82 PPARG (0.66) PPARGPPARAPPARD
SCHEMBL12096922 0.81 PPARG (0.66) PPARGPPARAPPARDACLY

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
CN-102596906-A Use of indole derivatives as NURR-1 activators as agents for the treatment of Parkinson's disease FOURNIER LAB SA 2012-07-18 — — CN disclosed
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