SCHEMBL8944313

SCHEMBL8944313

CCCCOc1ccc(N(c2ccc(OC)cc2)c2ccc(OCCCC)cc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AHR P35869 1/20 0.53
LTA4H P09960 4/20 0.50
L3MBTL1 Q9Y468 3/20 0.49
MAPT P10636 2/20 0.49
HPGD P15428 1/20 0.49
ATM Q13315 1/20 0.49
NR5A1 Q13285 1/20 0.48
PTGES O14684 1/20 0.47
DRD2 P14416 1/20 0.47
DRD4 P21917 1/20 0.47
DRD3 P35462 1/20 0.47
CYP3A4 P08684 1/20 0.47
CYP2D6 P10635 1/20 0.47
KCNH2 Q12809 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
CA12 O43570 1/20 0.46
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
TSHR P16473 1/20 0.46
CA7 P43166 1/20 0.46

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
SCHEMBL8943807 1.00 AHR (0.53) AHRLTA4HL3MBTL1MAPTHPGD
SCHEMBL8944174 0.96 NR5A1 (0.55) AHRLTA4HL3MBTL1MAPTHPGD
SCHEMBL8944067 0.94 NR5A1 (0.58) AHRLTA4HL3MBTL1MAPTNR5A1
SCHEMBL8943847 0.94 NR5A1 (0.58) AHRLTA4HL3MBTL1MAPTNR5A1
SCHEMBL8943974 0.94 NR5A1 (0.58) AHRLTA4HL3MBTL1MAPTNR5A1
SCHEMBL8943945 0.94 NR5A1 (0.58) AHRLTA4HL3MBTL1MAPTNR5A1
SCHEMBL8943679 0.94 NR5A1 (0.58) AHRLTA4HL3MBTL1MAPTNR5A1
SCHEMBL8943762 0.94 MAPT (0.54) AHRL3MBTL1MAPTHPGDATM
SCHEMBL8943641 0.93 LTA4H (0.58) AHRLTA4HL3MBTL1MAPTHPGD
SCHEMBL8944354 0.92 TSHR (0.49) AHRLTA4HL3MBTL1MAPTHPGD

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-5480765-A PRESSURE AND HEAT SENSITIVE PAPER, IMPROVED PHOTOSTABILITY BY ADDITION OF TRIARYLAMINE COMPOUND FUJI PHOTO FILM CO., LTD. (JP) 1996-01-02 US disclosed