SCHEMBL8931919

SCHEMBL8931919

CCCCCCCC(=O)On1c(Cc2ccccc2)nc2cc(-c3ccccc3-n3ncnn3)ccc21

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PPARG P37231 7/20 0.36
PDE4A P27815 1/20 0.35
PDE4B Q07343 1/20 0.35
PDE4C Q08493 1/20 0.35
PDE4D Q08499 1/20 0.35
AGTR1 P30556 2/20 0.34
AGTR2 P50052 2/20 0.34
HDAC1 Q13547 1/20 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
SCHEMBL8932034 0.73 AGTR1 (0.50) AGTR1AGTR2
SCHEMBL8931831 0.68 AGTR1 (0.47) AGTR1AGTR2
SCHEMBL8931812 0.67 AGTR1 (0.47) AGTR1AGTR2
SCHEMBL8931794 0.65 AGTR1 (0.44) AGTR1AGTR2
SCHEMBL8931893 0.63 AGTR1 (0.45) AGTR1AGTR2
SCHEMBL8931821 0.62 APEX1 (0.47) PPARGAGTR1AGTR2
SCHEMBL8931865 0.61 PTPN11 (0.52) PPARGAGTR1AGTR2
SCHEMBL8931823 0.61 AGTR1 (0.43) PPARGAGTR1AGTR2
SCHEMBL8931804 0.61 GABRA1 (0.42) PPARGAGTR1AGTR2
SCHEMBL6946448 0.59 TSHR (0.49)

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-5693633-A Angiotensin II antagonists ELI LILLY AND COMPANY (US) 1997-12-02 US disclosed