SCHEMBL8775846

SCHEMBL8775846

C[Si](C)(C)OCCCC(O)(c1cccnc1)c1cccc(C(F)(F)F)c1

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 2/20 0.46
TBXAS1 P24557 2/20 0.41
TBXA2R P21731 1/20 0.41
KIF11 P52732 1/20 0.40
CYP3A4 P08684 4/20 0.40
CYP3A5 P20815 4/20 0.40
KCNA5 P22460 1/20 0.39
TSHR P16473 2/20 0.38
KMT2A Q03164 2/20 0.38
MEN1 O00255 1/20 0.38
CYP11B1 P15538 1/20 0.36
CYP11B2 P19099 1/20 0.36
SIGMAR1 Q99720 1/20 0.36
NPY5R Q15761 1/20 0.36
KDM4E B2RXH2 1/20 0.35
POLB P06746 1/20 0.35
VNN1 O95497 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
SCHEMBL8775899 0.83 CYP19A1 (0.52) CYP19A1TBXAS1TBXA2RKIF11CYP3A4
SCHEMBL11632766 0.69 KCNA5 (0.51) CYP19A1CYP3A4KCNA5SIGMAR1KDM4E
SCHEMBL11630182 0.68 CYP3A4 (0.57) CYP19A1KIF11CYP3A4CYP3A5KCNA5
SCHEMBL1380025 0.68 KCNA5 (0.57) CYP19A1CYP3A4CYP3A5KCNA5CYP11B1
SCHEMBL6980412 0.66 CES2 (0.44) KIF11TSHRKMT2AMEN1
SCHEMBL7068828 0.65 CYP19A1 (0.57) CYP19A1KIF11CYP3A4CYP3A5KCNA5
SCHEMBL13577 0.65 CYP19A1 (0.57) CYP19A1KIF11CYP3A4CYP3A5KCNA5
SCHEMBL29387897 0.65 CYP19A1 (0.57) CYP19A1KIF11CYP3A4CYP3A5KCNA5
SCHEMBL23312242 0.65 CYP19A1 (0.45) CYP19A1KIF11CYP3A4CYP3A5TSHR
SCHEMBL11138899 0.64 CYP19A1 (0.58) CYP19A1KCNA5

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
EP-0807626-A1 N-HYDROXYUREA DERIVATIVES Nikken Chemicals Company, Limited (JP) 1997-11-19 EP disclosed