SCHEMBL6532094

SCHEMBL6532094

Cl[Si](Cl)(Cl)CCc1ccccc1.[SiH4]

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.50
ALDH1A1 P00352 2/20 0.46
HPGD P15428 1/20 0.46
ALOX15 P16050 1/20 0.46
ALOX12 P18054 1/20 0.46
CASP1 P29466 1/20 0.46
HSD17B10 Q99714 1/20 0.46
MAOA P21397 4/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
MAOB P27338 3/20 0.44
NPC1 O15118 2/20 0.44
RAB9A P51151 2/20 0.44
KDM1A O60341 1/20 0.44
LMNA P02545 1/20 0.44
CYP1A2 P05177 1/20 0.44
CYP3A4 P08684 1/20 0.44
HTR1A P08908 1/20 0.44
ADRA2A P08913 1/20 0.44
CYP2C8 P10632 1/20 0.44
CYP2D6 P10635 1/20 0.44

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
SCHEMBL208903 0.97 TDP1 (0.52) TDP1ALDH1A1HPGDALOX15ALOX12
Toluene SCHEMBL18394201 0.87 LMNA (0.46) TDP1ALDH1A1HPGDALOX15ALOX12
SCHEMBL5493502 0.84 FFAR1 (0.48) LMNACYP1A2IDO1TSHRPTGS1
SCHEMBL6848455 0.84 CA2 (0.38) TDP1ALDH1A1MAOAMAOBCYP1A2
SCHEMBL1599233 0.83 SIGMAR1 (0.48) ALDH1A1HPGDALOX15ALOX12CASP1
SCHEMBL1482295 0.82 TDP1 (0.52) TDP1ALDH1A1HPGDALOX15ALOX12
SCHEMBL1030793 0.82 TDP1 (0.52) TDP1ALDH1A1HPGDALOX15ALOX12
SCHEMBL1203381 0.81 MAOA (0.52) MAOAMAOBCYP2D6HTR2AKCNH2
SCHEMBL5482754 0.79 SIGMAR1 (0.52) MAOAMAOBSIGMAR1
SCHEMBL5488263 0.79 SIGMAR1 (0.52) MAOAMAOBSIGMAR1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6860956-B2 Methods of creating patterns on substrates and articles of manufacture resulting therefrom AGENCY FOR SCIENCE, TECHNOLOGY & RESEARCH (SG) 2005-03-01 US disclosed
WO-2004107045-A2 METHODS OF CREATING PATTERNS ON SUBSTRATES AND ARTICLES OF MANUFACTURE RESULTING THEREFROM AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2004-12-09 WO disclosed
US-20040231781-A1 Methods of creating patterns on substrates and articles of manufacture resulting therefrom AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2004-11-25 US disclosed