SCHEMBL7536675

SCHEMBL7536675

CN(C)c1ccc(C(c2ccc(N(C)C)cc2)c2cccc(F)c2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.51
NPC1 O15118 1/20 0.51
RAB9A P51151 1/20 0.51
SLC2A1 P11166 1/20 0.49
TSHR P16473 2/20 0.45
CYP1A2 P05177 1/20 0.45
CYP3A4 P08684 1/20 0.45
MAPT P10636 1/20 0.45
MAPK1 P28482 1/20 0.45
PHLPP2 Q6ZVD8 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
AOC3 Q16853 1/20 0.43
SLC6A2 P23975 2/20 0.41
SLC6A4 P31645 2/20 0.41
ALDH1A1 P00352 1/20 0.39
ALOX15 P16050 1/20 0.39
HSD17B10 Q99714 1/20 0.39
APP P05067 1/20 0.39
MAT2A P31153 1/20 0.38

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
SCHEMBL4078129 0.80 HDAC4 (0.50) AOC3HDAC4HDAC7HDAC5IDO1
SCHEMBL6558657 0.79 SLC2A1 (0.49) KMT2ANPC1RAB9ASLC2A1TSHR
SCHEMBL61350 0.78 SLC2A1 (0.61) KMT2ANPC1RAB9ASLC2A1TSHR
SCHEMBL7110610 0.78 SLC2A1 (0.61) KMT2ANPC1RAB9ASLC2A1TSHR
SCHEMBL61574 0.78 SLC2A1 (0.71) KMT2ASLC2A1TSHRCYP1A2CYP3A4
SCHEMBL9626237 0.78 SLC2A1 (0.71) KMT2ASLC2A1TSHRCYP1A2CYP3A4
Water SCHEMBL10498815 0.77 SLC2A1 (0.59) KMT2ANPC1RAB9ASLC2A1TSHR
SCHEMBL31409213 0.76 TAAR1 (0.52) AOC3SLC6A2SLC6A4HDAC4HDAC7
SCHEMBL10874697 0.75 SLC2A1 (0.45) KMT2ANPC1RAB9ASLC2A1TSHR
SCHEMBL4540010 0.75 HDAC4 (0.73) KMT2ANPC1RAB9ASLC6A2SLC6A4

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-6479217-B1 PHOTOSENSITIVE RECORDING; APPLYING ACTINIC RADIATION; PHOTOPOLYMERIZATION SPECTRA GROUP LIMITED, INC. 2002-11-12 US disclosed
US-20020160310-A1 Method for producing selectively colorable printing plates SPECTRA GROUP LIMITED, INC. 2002-10-31 US disclosed
US-6433035-B1 LEUCO DYE OR DI-, TRI- OR MONOARYLMETHANE DYE COLOR FORMERS YIELD CATIONIC DYE WHEN EXPOSED TO ACTINIC RADIATION IN PRESENCE OF OXIDIZER; BLEACHING AT HIGHER DOSAGES; CURING SPECTRA GROUP LIMITED, INC. 2002-08-13 US disclosed
US-6309797-B1 CONTAINING OXIDIZER; EXPOSURE TO ACTINIC RADIATION SPECTRA GROUP LIMITED, INC. 2001-10-30 US disclosed