SCHEMBL22966409

SCHEMBL22966409

Cc1c(OC#N)cccc1-c1ccc(C(C)(C)c2ccc(OC#N)cc2)cc1

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PPARG P37231 1/20 0.32
PPARA Q07869 1/20 0.32
KIF11 P52732 1/20 0.31
PDCD1 Q15116 1/20 0.30
CD274 Q9NZQ7 1/20 0.30

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
SCHEMBL22966265 0.94 KIF11 (0.34) KIF11PDCD1CD274
SCHEMBL22966272 0.87 AR (0.36) PPARGPPARA
SCHEMBL25873157 0.83 CYP3A4 (0.31)
SCHEMBL25873159 0.82 CYP3A4 (0.42)
SCHEMBL22966420 0.81 AR (0.38) KIF11
SCHEMBL20547222 0.79 KIF11 (0.42) PPARGKIF11
SCHEMBL22966431 0.79 KIF11 (0.42) PPARGKIF11
SCHEMBL22966364 0.79 KIF11 (0.42) PPARGKIF11
SCHEMBL1555244 0.77 HPGD (0.41) PPARGKIF11
SCHEMBL7789786 0.77 HPGD (0.41) PPARGKIF11

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240016699-A1 PHARMACEUTICAL PACKAGES WITH COATINGS COMPRISING POLYCYANURATES CORNING INC (US) 2024-01-18 US disclosed
US-11707411-B2 Pharmaceutical packages with coatings comprising polycyanurates CORNING INCORPORATED (US) 2023-07-25 US disclosed
US-20210038474-A1 PHARMACEUTICAL PACKAGES WITH COATINGS COMPRISING POLYCYANURATES CORNING INCORPORATED 2021-02-11 US disclosed