SCHEMBL12866325

SCHEMBL12866325

CC1=[N+](C)c2ccc(OC=O)cc2C1(C)C

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
VDR P11473 5/20 0.44
MEN1 O00255 4/20 0.35
LMNA P02545 4/20 0.35
MAPT P10636 4/20 0.35
THRB P10828 4/20 0.35
KMT2A Q03164 4/20 0.35
RECQL P46063 3/20 0.35
HTT P42858 3/20 0.35
TDP1 Q9NUW8 3/20 0.35
KDM4E B2RXH2 2/20 0.35
APEX1 P27695 1/20 0.35
NPC1 O15118 2/20 0.32
S1PR4 O95977 2/20 0.32
ALDH1A1 P00352 2/20 0.32
POLB P06746 2/20 0.32
ALPG P10696 2/20 0.32
PKM P14618 2/20 0.32
S1PR1 P21453 2/20 0.32
NTSR1 P30989 2/20 0.32
RAB9A P51151 2/20 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
SCHEMBL4615881 0.81 VDR (0.58) VDRMEN1LMNAMAPTTHRB
Iodide SCHEMBL6248897 0.80 VDR (0.57) VDRMEN1LMNAMAPTTHRB
Hydrochloric Acid SCHEMBL4613582 0.80 VDR (0.57) VDRMEN1LMNAMAPTTHRB
Bromide SCHEMBL4614412 0.80 VDR (0.57) VDRMEN1LMNAMAPTTHRB
Sulfuric Acid SCHEMBL4616814 0.78 VDR (0.52) VDRMEN1LMNAMAPTTHRB
SCHEMBL15293516 0.77 MAPT (0.44) VDRMEN1LMNAMAPTTHRB
SCHEMBL4614366 0.76 VDR (0.53) VDRMEN1LMNAMAPTTHRB
Sulfuric Acid SCHEMBL4617371 0.75 VDR (0.50) VDRMEN1LMNAMAPTTHRB
SCHEMBL12934507 0.75 HTT (0.42) VDRMEN1LMNAMAPTTHRB
SCHEMBL19052148 0.72 MEN1 (0.36) VDRMEN1LMNAMAPTTHRB

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-8338700-B2 Dye-sensitized photoelectric conversion device NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2012-12-25 US disclosed
US-8338701-B2 Dye-sensitized photoelectric conversion device NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2012-12-25 US disclosed
US-20110030801-A1 Dye-Sensitized Photoelectric Conversion Device NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2011-02-10 US disclosed
US-20110031446-A1 Dye-Sensitized Photoelectric Conversion Device NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2011-02-10 US disclosed