SCHEMBL8932064

SCHEMBL8932064

COc1ccc(C(c2ccccc2)(c2ccc(OC)cc2)C(OCc2cccc(OC)c2)[C@H]2O[C@@](COc3ccc(NC(=O)C(F)(F)F)cc3)(n3cc(C)c(=O)[nH]c3=O)C[C@@]2(O)[Si](C)(C)C(C)(C)C)cc1

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
FPR1 P21462 2/20 0.32
FPR2 P25090 2/20 0.32
NR1H4 Q96RI1 1/20 0.31
TP53 P04637 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
SCHEMBL8931932 0.91
SCHEMBL8931999 0.88 ALDH1A1 (0.32) FPR1FPR2
SCHEMBL8932126 0.88 NQO2 (0.31)
SCHEMBL8932105 0.85 PLA2G2A (0.32)
SCHEMBL8931951 0.84
SCHEMBL8931981 0.83
SCHEMBL8932019 0.82 JAK2 (0.30)
SCHEMBL8932069 0.78 TK1 (0.32)
SCHEMBL8932048 0.77 TK1 (0.34)
SCHEMBL8932104 0.76 MGAT2 (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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5681940-A CONTAIN TETRAHYDROTHIOPHENE OR PYROLIDINE RINGS ICN PHARMACEUTICALS (US) 1997-10-28 US disclosed