SCHEMBL11099586

SCHEMBL11099586

CC(C)N1CNC(=O)NC1=S

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.32
KDM4E B2RXH2 1/20 0.31
HCRTR1 O43613 1/20 0.31
ALDH1A1 P00352 1/20 0.31
GAA P10253 1/20 0.31
MAPT P10636 1/20 0.31

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
SCHEMBL11100095 0.81 MAPT (0.32) ALDH1A1MAPT
SCHEMBL11100171 0.76
SCHEMBL11102459 0.72
SCHEMBL13737400 0.71 TOP2A (0.45) CNR1KDM4EHCRTR1ALDH1A1GAA
SCHEMBL12299909 0.71
SCHEMBL22605558 0.68 BRPF1 (0.39) KDM4EALDH1A1GAAMAPT
SCHEMBL11106071 0.68 TDP1 (0.31) MAPT
SCHEMBL11099671 0.68 TAAR1 (0.33) CNR1ALDH1A1
SCHEMBL11104438 0.65 KMT2A (0.38) CNR1ALDH1A1GAAMAPT
SCHEMBL11107959 0.64 KMT2A (0.32)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4477442-A PENTOFURANOSYL-5,6-DIHYDROTRIAZINES IN TREATMENT OF VIRAL DISEASES THE UPJOHN COMPANY (US) 1984-10-16 US disclosed
US-4423212-A Nucleosides and process THE UPJOHN COMPANY (US) 1983-12-27 US disclosed
US-4239753-A Composition of matter and process THE UPJOHN COMPANY (US) 1980-12-16 US disclosed
US-4171431-A Nucleosides and process THE UPJOHN COMPANY (US) 1979-10-16 US disclosed