SCHEMBL8147254

SCHEMBL8147254

CCCCN(CCCC)c1ccc(Oc2ccccc2)cc1

nearest known ligand 0.59

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 6/20 0.59
MAPT P10636 4/20 0.55
HTT P42858 2/20 0.55
CNR2 P34972 1/20 0.48
ALDH1A1 P00352 3/20 0.47
GAA P10253 2/20 0.47
KMT2A Q03164 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
LMNA P02545 1/20 0.46
NR3C1 P04150 1/20 0.44
NR1H2 P55055 1/20 0.43
NR1H3 Q13133 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
HDAC3 O15379 1/20 0.43
TSHR P16473 1/20 0.43
KDM4E B2RXH2 1/20 0.43
POLB P06746 1/20 0.43

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
SCHEMBL1725467 0.87 LTA4H (0.47) LTA4HMAPTHTTCNR2ALDH1A1
SCHEMBL107013 0.82 CNR2 (0.49) MAPTCNR2ALDH1A1GAAKMT2A
SCHEMBL14564613 0.81 CNR2 (0.49) MAPTCNR2ALDH1A1GAAKMT2A
SCHEMBL17431102 0.81 CNR2 (0.49) MAPTCNR2ALDH1A1GAAKMT2A
SCHEMBL17663673 0.81 CNR2 (0.49) MAPTCNR2ALDH1A1GAAKMT2A
Hydrochloric Acid SCHEMBL2141325 0.81 CNR2 (0.48) MAPTCNR2ALDH1A1GAAKMT2A
SCHEMBL18074044 0.81 CNR2 (0.48) MAPTCNR2ALDH1A1GAAKMT2A
SCHEMBL29060106 0.80 BCHE (0.57) LTA4HMAPTCNR2GAALMNA
SCHEMBL7153351 0.80 EGFR (0.50) MAPTCNR2ALDH1A1GAANR1H2
SCHEMBL1573445 0.79 CNR2 (0.47) MAPTCNR2ALDH1A1GAALMNA

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
JP-2000072726-A HEXA-(P-AMINOPHENOXY OR P-AMINOPHENYLTHIO) BENZENE, CHARGE TRANSPORT MATERIAL AND PHOTOCONDUCTIVE MATERIAL FUJI PHOTO FILM CO LTD 2000-03-07 JP disclosed