SCHEMBL21291908

SCHEMBL21291908

O=C1C=CC(=O)N1CCc1ccc(Br)cc1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 8/20 0.66
GSK3A P49840 4/20 0.66
GSK3B P49841 4/20 0.66
CA1 P00915 2/20 0.59
CA2 P00918 2/20 0.59
CA4 P22748 2/20 0.59
CA9 Q16790 2/20 0.59
HSP90AA1 P07900 2/20 0.51
FAAH O00519 5/20 0.50
ALDH1A1 P00352 2/20 0.46
ALDH2 P05091 1/20 0.46
ALDH3A1 P30838 1/20 0.46
TLR9 Q9NR96 1/20 0.45
LMNA P02545 1/20 0.45
TP53 P04637 1/20 0.45
MAPT P10636 1/20 0.45
PKM P14618 1/20 0.45
HPGD P15428 1/20 0.45
XBP1 P17861 1/20 0.45
MAPK1 P28482 1/20 0.45

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
SCHEMBL23926407 0.80 MGLL (0.66) MGLLGSK3AGSK3BCA1CA2
SCHEMBL14677902 0.80 MGLL (0.66) MGLLGSK3AGSK3BCA1CA2
SCHEMBL19419960 0.80 GSK3A (0.66) MGLLGSK3AGSK3BCA1CA2
SCHEMBL20251099 0.80 MGLL (0.66) MGLLGSK3AGSK3BCA1CA2
SCHEMBL7542262 0.80 MGLL (0.66) MGLLGSK3AGSK3BCA1CA2
SCHEMBL7871290 0.79 MGLL (0.78) MGLLGSK3AGSK3BFAAHALDH1A1
SCHEMBL211905 0.79 GSK3A (1.00) MGLLGSK3AGSK3BCA1CA2
SCHEMBL22980462 0.78 CA1 (0.60) MGLLGSK3AGSK3BCA1CA2
SCHEMBL20375568 0.76 MGLL (0.65) MGLLGSK3AGSK3BCA1CA2
SCHEMBL2187848 0.76 CASP3 (0.65) GSK3BCA1CA2CA4CA9

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-20190285576-A1 SEMICONDUCTOR SENSOR, METHOD FOR PRODUCING THE SAME, AND COMBINED SENSOR TORAY INDUSTRIES, INC. (JP) 2019-09-19 US disclosed
EP-3531131-A1 SEMICONDUCTOR SENSOR AND MANUFACTURING METHOD FOR SAME, AND COMPOUND SENSOR Toray Industries, Inc. (JP) 2019-08-28 EP disclosed
CN-109844530-A Semiconductor transducer and its manufacturing method and compound sensor 东丽株式会社 2019-06-04 CN disclosed