SCHEMBL8497972

SCHEMBL8497972

Cl[SiH](Cl)c1ccccc1-c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 1/20 0.48
ALDH1A1 P00352 5/20 0.42
HSD17B10 Q99714 2/20 0.42
HPGD P15428 1/20 0.42
BCL2L1 Q07817 1/20 0.42
MAPK1 P28482 1/20 0.42
BACE1 P56817 1/20 0.39
DPP4 P27487 1/20 0.38
CTRC Q99895 2/20 0.38
MGLL Q99685 1/20 0.38
HDAC4 P56524 1/20 0.37
HDAC2 Q92769 1/20 0.37
HDAC8 Q9BY41 1/20 0.37
HDAC6 Q9UBN7 1/20 0.37
TDP1 Q9NUW8 1/20 0.35
BCAT2 O15382 1/20 0.35
CYP1A2 P05177 1/20 0.35
CASP3 P42574 1/20 0.34
SENP8 Q96LD8 1/20 0.34
SENP7 Q9BQF6 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
SCHEMBL3482594 0.82 MEN1 (0.37) ALDH1A1HPGDMAPK1TDP1
SCHEMBL2454734 0.79 ALDH1A1 (0.46) CYP2A6ALDH1A1HSD17B10HPGDBCL2L1
SCHEMBL29776868 0.75 ALDH1A1 (0.42) CYP2A6ALDH1A1HSD17B10HPGDBCL2L1
SCHEMBL7618954 0.75 ALDH1A1 (0.48) CYP2A6ALDH1A1HSD17B10HPGDBCL2L1
SCHEMBL16562891 0.75 ALDH1A1 (0.42) CYP2A6ALDH1A1HSD17B10HPGDBCL2L1
SCHEMBL15067067 0.74 GSTP1 (0.52) CYP2A6HDAC4HDAC2HDAC8CYP1A2
SCHEMBL29247970 0.73 ALDH1A1 (0.41) CYP2A6ALDH1A1HSD17B10HPGDBCL2L1
SCHEMBL21447 0.71 ALDH1A1 (0.61) CYP2A6ALDH1A1HSD17B10HPGDBCL2L1
Benzene SCHEMBL28035419 0.71 ALDH1A1 (0.61) CYP2A6ALDH1A1HSD17B10HPGDBCL2L1
SCHEMBL2361430 0.71 ALDH1A1 (0.61) CYP2A6ALDH1A1HSD17B10HPGDBCL2L1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-5051460-A None JP disclosed
EP-0423948-B1 Removal of hydrogen-containing silanes from organosilane mixtures DOW CORNING (US) 1999-01-20 EP disclosed
JP-H0551460-A FLUORINE-CONTAINING SILICONE RESIN, PHOTOSENSITIVE RESIN COMPOSITION CONTAINING THE SAME RESIN AND MULTI-LAYER WIRING DEVICE USING THE SAME COMPOSITION FUJITSU LTD 1993-03-02 JP disclosed
EP-0423948-A2 Removal of hydrogen-containing silanes from organosilane mixtures DOW CORNING CORPORATION (US) 1991-04-24 EP disclosed
US-4985579-A Reacting with a Hydrogen Halide, Separation by Distillation DOW CORNING CORPORATION (US) 1991-01-15 US disclosed
JP-H00551460-A 0001-01-01 JP disclosed