SCHEMBL8833294

SCHEMBL8833294

N#Cc1ccc(-c2ccc(OCCCCN3C(=O)c4ccccc4C3=O)cc2)cc1

nearest known ligand 0.61

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.61
MAPT P10636 1/20 0.61
SMN1; SMN2 Q16637 1/20 0.61
HPGD P15428 1/20 0.55
NPSR1 Q6W5P4 1/20 0.55
MMP2 P08253 4/20 0.54
MMP3 P08254 3/20 0.54
NPC1 O15118 1/20 0.53
HRH3 Q9Y5N1 6/20 0.51
HRH2 P25021 4/20 0.51
HRH1 P35367 4/20 0.51
MMP9 P14780 2/20 0.50
ALDH1A1 P00352 1/20 0.50
HDAC1 Q13547 1/20 0.48
HDAC2 Q92769 1/20 0.48
MMP13 P45452 1/20 0.47

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
SCHEMBL8484092 0.96 RAB9A (0.66) RAB9AMAPTSMN1; SMN2HPGDNPSR1
SCHEMBL6740077 0.92 RAB9A (0.72) RAB9AMAPTSMN1; SMN2HPGDNPSR1
SCHEMBL6542913 0.88 RAB9A (0.56) RAB9AMAPTSMN1; SMN2HPGDNPSR1
SCHEMBL3922051 0.88 HPGD (0.70) RAB9AMAPTSMN1; SMN2HPGDNPSR1
SCHEMBL8483472 0.88 RAB9A (0.74) RAB9AMAPTSMN1; SMN2HPGDNPSR1
SCHEMBL10680795 0.86 RAB9A (0.72) RAB9AMAPTSMN1; SMN2HPGDNPSR1
SCHEMBL10682756 0.86 RAB9A (0.72) RAB9AMAPTSMN1; SMN2HPGDNPSR1
SCHEMBL10675533 0.86 RAB9A (0.72) RAB9AMAPTSMN1; SMN2HPGDNPSR1
SCHEMBL10683824 0.86 RAB9A (0.72) RAB9AMAPTSMN1; SMN2HPGDNPSR1
SCHEMBL10683303 0.86 RAB9A (0.72) RAB9AMAPTSMN1; SMN2HPGDNPSR1

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-5645758-A Liquid crystal composition, liquid crystal device using the same, light controlling element, recording medium, and light shutter KABUSHIKI KAISHA TOYOTA CHUO KENKYUSHO (JP) 1997-07-08 US disclosed