SCHEMBL19600561

SCHEMBL19600561

CN(C)Cc1ccc([Si](C)(C)C)s1

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 2/20 0.46
CYP2D6 P10635 1/20 0.46
CYP2C19 P33261 1/20 0.46
ALDH1A1 P00352 2/20 0.36
HTT P42858 1/20 0.36
RAB9A P51151 1/20 0.36
KMT2A Q03164 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
HRH3 Q9Y5N1 1/20 0.33
TSHR P16473 1/20 0.33
RIPK1 Q13546 1/20 0.33
PARP1 P09874 1/20 0.32
ACHE P22303 1/20 0.31
CHRNB2 P17787 1/20 0.31
CHRNA4 P43681 1/20 0.31
ADORA2A P29274 1/20 0.31
ADORA1 P30542 1/20 0.31

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
SCHEMBL19605892 0.73 CYP2E1 (0.42) CYP2A6CYP2D6CYP2C19
SCHEMBL8015367 0.73 PRMT6 (0.50) CYP2A6CYP2D6CYP2C19ALDH1A1KMT2A
SCHEMBL13185588 0.73 CYP2A6 (0.44) CYP2A6CYP2D6CYP2C19ALDH1A1HTT
SCHEMBL7277336 0.71 CYP2A6 (0.43) CYP2A6CYP2D6CYP2C19ALDH1A1HTT
SCHEMBL8008762 0.71 CYP2A6 (0.43) CYP2A6CYP2D6CYP2C19ALDH1A1HTT
SCHEMBL21127888 0.71 CYP2A6 (0.43) CYP2A6CYP2D6CYP2C19ALDH1A1HTT
SCHEMBL621621 0.71 CYP2A6 (0.43) CYP2A6CYP2D6CYP2C19ALDH1A1HTT
SCHEMBL8015366 0.71 CYP2A6 (0.43) CYP2A6CYP2D6CYP2C19ALDH1A1HTT
Hydrochloric Acid SCHEMBL10741023 0.70 CYP2A6 (0.42) CYP2A6CYP2D6CYP2C19ALDH1A1HTT
SCHEMBL11059206 0.68 KCNH2 (0.39) ALDH1A1HTTRAB9AKMT2ATSHR

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
US-20190304707-A1 PHOTOELECTRIC CONVERSION ELEMENT, SOLAR CELL AND COMPOSITION FUJIFILM CORPORATION (JP) 2019-10-03 US disclosed
US-10418186-B2 Photoelectric conversion element, solar cell and composition FUJIFILM CORPORATION (JP) 2019-09-17 US disclosed
US-20170330694-A1 PHOTOELECTRIC CONVERSION ELEMENT, SOLAR CELL AND COMPOSITION FUJIFILM CORPORATION (JP) 2017-11-16 US disclosed
US-20170330694-A1 PHOTOELECTRIC CONVERSION ELEMENT, SOLAR CELL AND COMPOSITION FUJIFILM CORPORATION (JP) 2017-11-16 US disclosed