SCHEMBL3800627

SCHEMBL3800627

C[Si](C)(C)C#Cc1ccc2cc3cc4cc5ccccc5cc4cc3cc2c1C#C[Si](C)(C)C

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.33
HSD17B10 Q99714 4/20 0.33
CYP1B1 Q16678 2/20 0.33
HIF1A Q16665 2/20 0.33
ELANE P08246 1/20 0.33
CYP1A2 P05177 3/20 0.32
MAPT P10636 2/20 0.32
CYP3A4 P08684 2/20 0.32
HPGD P15428 2/20 0.32
KDM4E B2RXH2 1/20 0.32
MEN1 O00255 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C9 P11712 1/20 0.32
TSHR P16473 1/20 0.32
CYP2C19 P33261 1/20 0.32
KMT2A Q03164 1/20 0.32
CYP1A1 P04798 1/20 0.32
ALOX15 P16050 1/20 0.32
CASP1 P29466 1/20 0.32
CASP7 P55210 1/20 0.32

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
SCHEMBL9473040 0.98 ALDH1A1 (0.34) ALDH1A1HSD17B10CYP1B1HIF1AELANE
SCHEMBL17442987 0.84 CYP1B1 (0.33) ALDH1A1HSD17B10CYP1B1HIF1ACYP1A2
SCHEMBL1657492 0.84 CYP1B1 (0.33) ALDH1A1HSD17B10CYP1B1HIF1ACYP1A2
SCHEMBL28270454 0.83 ALDH1A1 (0.38) ALDH1A1HSD17B10CYP1B1HIF1ACYP1A2
SCHEMBL28228095 0.82 CYP1A2 (0.32) ALDH1A1HSD17B10CYP1B1HIF1AELANE
SCHEMBL21996465 0.82 CYP1B1 (0.33) ALDH1A1HSD17B10CYP1B1HIF1ACYP1A2
SCHEMBL18081447 0.81 ELANE (0.40) ALDH1A1HSD17B10CYP1B1HIF1AELANE
SCHEMBL9472950 0.80 ALDH1A1 (0.38) ALDH1A1HSD17B10CYP1B1HIF1AELANE
SCHEMBL656268 0.80 ELANE (0.37) ALDH1A1HSD17B10CYP1B1HIF1AELANE
SCHEMBL3800629 0.79 ALDH1A1 (0.38) ALDH1A1HSD17B10HIF1AELANECYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2206115-A1 APPARATUS AND METHODS FOR THRESHOLD CONTROL OF PHOTOPOLYMERIZATION FOR HOLOGRAPHIC DATA STORAGE USING AT LEAST TWO WAVELENGTHS STX Aprilis, Inc. (US) 2010-07-14 EP claimed
US-20090202919-A1 Apparatus and methods for threshold control of photopolymerization for holographic data storage using at least two wavelengths STX APRILIS, INC. (US) 2009-08-13 US claimed
WO-2009054981-A9 APPARATUS AND METHODS FOR THRESHOLD CONTROL OF PHOTOPOLYMERIZATION FOR HOLOGRAPHIC DATA STORAGE USING AT LEAST TWO WAVELENGTHS STX APRILIS INC (US) 2009-07-09 WO claimed
WO-2009054981-A1 APPARATUS AND METHODS FOR THRESHOLD CONTROL OF PHOTOPOLYMERIZATION FOR HOLOGRAPHIC DATA STORAGE USING AT LEAST TWO WAVELENGTHS STX APRILIS, INC. (US) 2009-04-30 WO claimed
EP-2206115-A1 APPARATUS AND METHODS FOR THRESHOLD CONTROL OF PHOTOPOLYMERIZATION FOR HOLOGRAPHIC DATA STORAGE USING AT LEAST TWO WAVELENGTHS STX Aprilis, Inc. (US) 2010-07-14 EP disclosed
US-20090202919-A1 Apparatus and methods for threshold control of photopolymerization for holographic data storage using at least two wavelengths STX APRILIS, INC. (US) 2009-08-13 US disclosed
WO-2009054981-A9 APPARATUS AND METHODS FOR THRESHOLD CONTROL OF PHOTOPOLYMERIZATION FOR HOLOGRAPHIC DATA STORAGE USING AT LEAST TWO WAVELENGTHS STX APRILIS INC (US) 2009-07-09 WO disclosed
WO-2009054981-A1 APPARATUS AND METHODS FOR THRESHOLD CONTROL OF PHOTOPOLYMERIZATION FOR HOLOGRAPHIC DATA STORAGE USING AT LEAST TWO WAVELENGTHS STX APRILIS, INC. (US) 2009-04-30 WO disclosed