SCHEMBL6860477

SCHEMBL6860477

C[Si](C)(F)C(c1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.43
TSHR P16473 2/20 0.43
KCNN4 O15554 4/20 0.39
MAPK1 P28482 2/20 0.39
NR1H2 P55055 2/20 0.36
NR1H3 Q13133 2/20 0.36
TAAR1 Q96RJ0 1/20 0.36
ALOX15 P16050 1/20 0.36
ESR1 P03372 2/20 0.34
ESR2 Q92731 2/20 0.34
CYP3A4 P08684 2/20 0.34
PTPN1 P18031 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP2D6 P10635 1/20 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
SCHEMBL9745411 0.77 MAPK1 (0.42) ALDH1A1TSHRKCNN4MAPK1NR1H2
SCHEMBL6602971 0.74 ALDH1A1 (0.41) ALDH1A1TSHRKCNN4MAPK1NR1H2
SCHEMBL3743994 0.74 KCNN4 (0.39) ALDH1A1TSHRKCNN4MAPK1TAAR1
SCHEMBL6322919 0.74 TSHR (0.43) ALDH1A1TSHRKCNN4MAPK1TAAR1
SCHEMBL6324964 0.74 TSHR (0.43) ALDH1A1TSHRKCNN4MAPK1TAAR1
SCHEMBL6602963 0.74 ALDH1A1 (0.39) ALDH1A1TSHRKCNN4MAPK1NR1H2
SCHEMBL10332646 0.74 KCNN4 (0.39) ALDH1A1TSHRKCNN4MAPK1NR1H2
SCHEMBL10332647 0.74 KCNN4 (0.43) ALDH1A1TSHRKCNN4MAPK1TAAR1
SCHEMBL7754101 0.72 MAPK1 (0.42) ALDH1A1TSHRKCNN4MAPK1TAAR1
SCHEMBL7513086 0.70 MAPK1 (0.41) ALDH1A1TSHRKCNN4MAPK1NR1H2

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-6811822-B2 Method of waterproofing the surface of a polymer work piece Institut fur Mikrotechnik Mainz (DE) 2004-11-02 US disclosed
US-20030185992-A1 Method of waterproofing the surface of a polymer work piece INSTITUT FUR MIKROTECHNIK MAINZ GMBH (DE) 2003-10-02 US disclosed