SCHEMBL5077302

SCHEMBL5077302

CCOCC(CO[SiH2]C(C)(C)c1ccccc1)(Cc1ccccc1)Cc1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 1/20 0.34
TAAR1 Q96RJ0 1/20 0.34
CYP1A2 P05177 2/20 0.33
RECQL P46063 2/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
MAPK1 P28482 2/20 0.33
MMP8 P22894 1/20 0.33
LMNA P02545 1/20 0.33
CYP2D6 P10635 1/20 0.33
ALDH1A1 P00352 2/20 0.30
RAB9A P51151 2/20 0.30
SMN1; SMN2 Q16637 2/20 0.30
NPC1 O15118 1/20 0.30
HPGD P15428 1/20 0.30
PPARG P37231 1/20 0.30
PPARA Q07869 1/20 0.30
TACR1 P25103 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
SCHEMBL5078147 0.89 SLC6A2 (0.33) SLC6A2TAAR1CYP1A2RECQLCYP3A4
SCHEMBL5077364 0.86 SLC6A2 (0.36) SLC6A2TAAR1RECQLMMP8LMNA
SCHEMBL5078350 0.86 SLC6A2 (0.36) SLC6A2TAAR1CYP1A2RECQLCYP3A4
SCHEMBL5080808 0.84 SLC6A2 (0.35) SLC6A2TAAR1RECQLMMP8LMNA
SCHEMBL1791345 0.82 SLC6A2 (0.43) SLC6A2TAAR1CYP1A2RECQLCYP2C9
SCHEMBL5075175 0.81 MAPK1 (0.37) TAAR1MAPK1ALDH1A1SMN1; SMN2TACR1
SCHEMBL3842787 0.77 MAPK1 (0.43) TAAR1CYP3A4CYP2C19MAPK1ALDH1A1
SCHEMBL5081809 0.76 SLC6A2 (0.40) SLC6A2TAAR1CYP1A2RECQLCYP3A4
SCHEMBL5081737 0.76 SLC6A2 (0.42) SLC6A2TAAR1CYP1A2RECQLCYP3A4
SCHEMBL5075138 0.75 SLC6A2 (0.34) SLC6A2TAAR1MMP8LMNACYP2D6

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-7399812-B2 Silicon ether compounds and a method for the preparation thereof CHINA PETROLEUM & CHEMICAL CORPORATION (CN) 2008-07-15 US disclosed
US-20060183873-A1 Silicon ether compounds and a method for the preparation thereof BEIJING RESEARCH INSTITUTE OF CHEMICAL INDUSTRY, CHINA PETROLEUM & CHEMICAL CORPORATION (CN) 2006-08-17 US disclosed