SCHEMBL8944027

SCHEMBL8944027

c1ccc(N(c2ccccc2)c2ccc(OCCOc3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNA3 P22001 1/20 0.52
LTA4H P09960 7/20 0.50
PKM P14618 1/20 0.48
L3MBTL1 Q9Y468 3/20 0.48
CYP1A2 P05177 3/20 0.48
CYP2D6 P10635 3/20 0.48
CYP2C19 P33261 3/20 0.48
ALDH1A1 P00352 2/20 0.48
CYP2C9 P11712 2/20 0.48
TDP1 Q9NUW8 2/20 0.48
KDM4E B2RXH2 1/20 0.48
CYP3A4 P08684 1/20 0.48
MAPT P10636 1/20 0.48
TAAR1 Q96RJ0 1/20 0.46
RECQL P46063 1/20 0.46
PARP10 Q53GL7 1/20 0.46
PLA2G2A P14555 1/20 0.45
HTT P42858 1/20 0.44
LSS P48449 1/20 0.44
CHRNB2 P17787 1/20 0.44

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
SCHEMBL8944179 0.94 KDM4E (0.50) KCNA3LTA4HPKML3MBTL1CYP1A2
SCHEMBL8943810 0.93 KCNA3 (0.56) KCNA3LTA4HL3MBTL1CYP1A2CYP2D6
SCHEMBL8944007 0.93 KCNA3 (0.62) KCNA3LTA4HL3MBTL1CYP1A2CYP2D6
SCHEMBL8943680 0.91 KCNA3 (0.60) KCNA3LTA4HL3MBTL1CYP1A2CYP2D6
SCHEMBL8943908 0.91 KCNA3 (0.60) KCNA3LTA4HL3MBTL1CYP1A2CYP2D6
SCHEMBL8944286 0.91 KCNA3 (0.60) KCNA3LTA4HL3MBTL1CYP1A2CYP2D6
SCHEMBL8944087 0.91 KCNA3 (0.60) KCNA3LTA4HL3MBTL1CYP1A2CYP2D6
SCHEMBL8943988 0.90 L3MBTL1 (0.59) LTA4HL3MBTL1CYP1A2CYP2D6CYP2C19
SCHEMBL12659398 0.90 L3MBTL1 (0.48) KCNA3LTA4HPKML3MBTL1CYP1A2
SCHEMBL8943696 0.90 LTA4H (0.66) KCNA3LTA4HCYP1A2CYP2D6CYP2C19

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