SCHEMBL8608258

SCHEMBL8608258

CC(N)CNC(=O)c1cccc(C(C)(C)C)c1O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 1/20 0.44
PDCD1LG2 Q9BQ51 2/20 0.42
CD274 Q9NZQ7 2/20 0.42
POLB P06746 1/20 0.41
GABRA1 P14867 1/20 0.40
GABRB2 P47870 1/20 0.40
NR5A2 O00482 1/20 0.39
NR5A1 Q13285 1/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
GAA P10253 1/20 0.39
KMT2A Q03164 1/20 0.39
HSD17B10 Q99714 1/20 0.39
NPSR1 Q6W5P4 1/20 0.38
ALOX5 P09917 1/20 0.38
ALDH1A1 P00352 1/20 0.37
ESRRG P62508 1/20 0.36
KCNA3 P22001 1/20 0.36
CASR P41180 1/20 0.36
KDM4E B2RXH2 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
SCHEMBL8609755 0.81 NR5A2 (0.62) PDCD1LG2CD274NR5A2NR5A1GAA
SCHEMBL8608137 0.81 NR5A2 (0.46) CA2PDCD1LG2CD274POLBNR5A2
SCHEMBL8607707 0.80 CA2 (0.41) CA2GABRA1GABRB2ALDH1A1
SCHEMBL8606479 0.79 CA2 (0.47) CA2PDCD1LG2CD274GABRA1GABRB2
SCHEMBL18614009 0.78 NR5A2 (0.55) CA2POLBGABRA1GABRB2NR5A2
SCHEMBL7940297 0.78 CA2 (0.48) CA2GABRA1GABRB2NR5A2NR5A1
SCHEMBL8608448 0.78 GAA (0.40) CA2GABRA1GABRB2GAAKMT2A
SCHEMBL8608253 0.77 CA2 (0.44) CA2PDCD1LG2CD274POLBGABRA1
SCHEMBL8608260 0.77 ALOX5 (0.51) CA2NR5A2NR5A1NPC1HSD17B10
SCHEMBL8608126 0.77 LMNA (0.45) CA2NR5A2NR5A1GAAKMT2A

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-5847187-A Organic phosphorous compound, a process for producing the same and a use thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1998-12-08 US disclosed