SCHEMBL9322667

SCHEMBL9322667

C[Si]([O])(Cl)CCc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.44
ALDH1A1 P00352 3/20 0.42
HPGD P15428 1/20 0.41
ALOX15 P16050 1/20 0.41
ALOX12 P18054 1/20 0.41
CASP1 P29466 1/20 0.41
HSD17B10 Q99714 1/20 0.41
TAAR1 Q96RJ0 3/20 0.40
NPC1 O15118 3/20 0.40
RAB9A P51151 3/20 0.40
SMN1; SMN2 Q16637 3/20 0.40
LMNA P02545 2/20 0.40
ATM Q13315 1/20 0.40
KEAP1 Q14145 1/20 0.40
KDM1A O60341 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
HTR1A P08908 1/20 0.40
ADRA2A P08913 1/20 0.40
CYP2C8 P10632 1/20 0.40

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
SCHEMBL523393 0.82 TDP1 (0.48) TDP1ALDH1A1HPGDALOX15ALOX12
SCHEMBL3624272 0.82 TDP1 (0.48) TDP1ALDH1A1HPGDALOX15ALOX12
SCHEMBL523595 0.82 TDP1 (0.48) TDP1ALDH1A1HPGDALOX15ALOX12
SCHEMBL1030793 0.77 TDP1 (0.52) TDP1ALDH1A1HPGDALOX15ALOX12
SCHEMBL22283421 0.77 TDP1 (0.52) TDP1ALDH1A1HPGDALOX15ALOX12
SCHEMBL6420860 0.77 TDP1 (0.52) TDP1ALDH1A1HPGDALOX15ALOX12
SCHEMBL3389806 0.77 TDP1 (0.52) TDP1ALDH1A1HPGDALOX15ALOX12
SCHEMBL208903 0.77 TDP1 (0.52) TDP1ALDH1A1HPGDALOX15ALOX12
SCHEMBL16550634 0.77 TDP1 (0.52) TDP1ALDH1A1HPGDALOX15ALOX12
SCHEMBL1482295 0.77 TDP1 (0.52) TDP1ALDH1A1HPGDALOX15ALOX12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104893290-B Radiation-curable silicone composition 信越化学工业株式会社 2020-01-21 CN disclosed
EP-0404029-B1 Substantially odor free, UV curable organopolysiloxane release coating compositions and coating method GEN ELECTRIC (US) 1994-02-16 EP disclosed
US-4994299-A Epoxyhaloarylaklsiloxane with polyaryloniumhexafluorometalloid salt photoinitiator GENERAL ELECTRIC COMPANY (US) 1991-02-19 US disclosed
EP-0404029-A1 Substantially odor free, UV curable organopolysiloxane release coating compositions and coating method GENERAL ELECTRIC COMPANY (US) 1990-12-27 EP disclosed