SCHEMBL8119035

SCHEMBL8119035

C[SiH](C)OC(C1C(c2ccc(Br)cc2)CC(=O)N1C(=O)OC(C)(C)C)C(C)(C)C

nearest known ligand 0.37

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
RORC P51449 3/20 0.37
NR1H2 P55055 1/20 0.33
NR1H3 Q13133 1/20 0.33
LMNA P02545 1/20 0.32
FPR2 P25090 4/20 0.32
SLC6A2 P23975 3/20 0.31
SLC6A4 P31645 3/20 0.31
SLC6A3 Q01959 3/20 0.31
BRD4 O60885 1/20 0.31
HSD17B2 P37059 2/20 0.31
PDE5A O76074 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA4 P22748 1/20 0.31
CA7 P43166 1/20 0.31
KDM1A O60341 1/20 0.30
MAOA P21397 1/20 0.30
MAOB P27338 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
SCHEMBL352413 0.80 BUB1 (0.33)
SCHEMBL353103 0.74 KLK7 (0.43) NR1H2NR1H3
SCHEMBL6861095 0.72 KLK7 (0.33)
SCHEMBL211418 0.72 CHRM2 (0.35)
SCHEMBL4501438 0.71 CHRM2 (0.31)
SCHEMBL190827 0.69 NFKB1 (0.30)
SCHEMBL29691862 0.69 RORC (0.42) RORCNR1H2NR1H3LMNAFPR2
SCHEMBL8119034 0.69 RORC (0.37) RORCNR1H2NR1H3LMNAFPR2
SCHEMBL29779454 0.68 RORC (0.46) RORCNR1H2NR1H3LMNAFPR2
SCHEMBL29779329 0.68 RORC (0.46) RORCNR1H2NR1H3LMNAFPR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1015427-A1 SUBSTITUTED 2-PYRROLIDINONE ACTIVATORS OF PKC GEORGETOWN UNIVERSITY (US) 2000-07-05 EP disclosed
WO-1999012901-A1 SUBSTITUTED 2-PYRROLIDINONE ACTIVATORS OF PKC GEORGETOWN UNIVERSITY (US) 1999-03-18 WO disclosed