SCHEMBL16639876

SCHEMBL16639876

CC[C@@H](C)c1ccc2c(c1)c1ccccc1n2CC

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 10/20 0.58
KMT2A Q03164 6/20 0.58
KDM4E B2RXH2 6/20 0.58
MEN1 O00255 5/20 0.58
ALDH1A1 P00352 4/20 0.58
HTT P42858 2/20 0.58
MAPK1 P28482 2/20 0.58
HPGD P15428 2/20 0.58
HBB P68871 1/20 0.58
HSD17B10 Q99714 1/20 0.58
TDP1 Q9NUW8 1/20 0.58
LMNA P02545 6/20 0.52
POLB P06746 2/20 0.50
PKM P14618 1/20 0.50
CYP1A2 P05177 1/20 0.49
CYP3A4 P08684 1/20 0.49
CYP2D6 P10635 1/20 0.49
CYP2C9 P11712 1/20 0.49
CYP2C19 P33261 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49

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
SCHEMBL13171438 1.00 MAPT (0.58) MAPTKMT2AKDM4EMEN1ALDH1A1
SCHEMBL14430930 0.91 MAPT (0.50) MAPTKMT2AKDM4EMEN1ALDH1A1
SCHEMBL12036093 0.88 MAPT (0.52) MAPTKMT2AKDM4EMEN1ALDH1A1
SCHEMBL12036098 0.88 MAPT (0.52) MAPTKMT2AKDM4EMEN1ALDH1A1
SCHEMBL8232713 0.87 MAPT (0.61) MAPTKMT2AKDM4EMEN1ALDH1A1
SCHEMBL12083593 0.86 GPR3 (0.52) MAPTKMT2AKDM4EMEN1ALDH1A1
SCHEMBL253310 0.85 MAPT (0.63) MAPTKMT2AKDM4EMEN1ALDH1A1
SCHEMBL12036097 0.85 MAPT (0.49) MAPTKMT2AKDM4EMEN1ALDH1A1
SCHEMBL23918440 0.84 MAPT (0.58) MAPTKMT2AKDM4EMEN1ALDH1A1
SCHEMBL6320904 0.84 MAPT (0.62) MAPTKMT2AKDM4EMEN1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150102307-A1 ELECTROLUMINESCENT ELEMENT, METHOD FOR MANUFACTURING ELECTROLUMINESCENT ELEMENT, DISPLAY DEVICE, AND ILLUMINATION DEVICE SHOWA DENKO K.K. (JP) 2015-04-16 US disclosed