SCHEMBL5485087

SCHEMBL5485087

Cl[Si](Cl)(Cl)Cc1ccc(Br)cc1

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 3/20 0.42
HTR2A P28223 1/20 0.42
CYP2A6 P11509 1/20 0.42
IDO1 P14902 4/20 0.41
CYP19A1 P11511 1/20 0.41
CYP11B1 P15538 1/20 0.41
CYP11B2 P19099 1/20 0.41
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
HRH3 Q9Y5N1 1/20 0.36
HTR1D P28221 1/20 0.35
PYCR1 P32322 2/20 0.34

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
SCHEMBL4450244 0.86 ESR1 (0.38) IDO1
SCHEMBL2687231 0.78 HRH3 (0.41) TAAR1CYP2A6CYP19A1CYP11B1CYP11B2
SCHEMBL7557619 0.76 CA1 (0.39)
SCHEMBL1479279 0.76 IDO1 (0.48) TAAR1HTR2ACYP2A6IDO1CYP19A1
SCHEMBL5488977 0.75 TAAR1 (0.50) TAAR1HTR2ACYP2A6IDO1CYP19A1
SCHEMBL19065738 0.74 ESR1 (0.58) TAAR1HTR2ACYP2A6IDO1CYP19A1
SCHEMBL5484080 0.74 IDO1 (0.46) TAAR1CYP2A6IDO1CYP19A1CYP11B1
SCHEMBL2684489 0.74 IDO1 (0.46) TAAR1IDO1CYP19A1CYP11B1CYP11B2
SCHEMBL5552238 0.74 ESR1 (0.31)
SCHEMBL242725 0.72 CALM1 (0.45) TAAR1HTR2ACYP2A6IDO1CYP19A1

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
US-7291747-B2 Silicon compounds and process for preparation thereof CHISSO CORPORATION (JP) 2007-11-06 US disclosed
US-20040143081-A1 Novel silicon compounds and process for preparation thereof JNC CORPORATION (JP) 2004-07-22 US disclosed