SCHEMBL8554888

SCHEMBL8554888

CCCCCCc1ccc2nc(-c3ccc(O)cc3)sc2c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.56
SMN1; SMN2 Q16637 3/20 0.56
TP53 P04637 2/20 0.56
THRB P10828 1/20 0.56
NPC1 O15118 4/20 0.53
RAB9A P51151 4/20 0.53
STAT3 P40763 1/20 0.53
ATM Q13315 1/20 0.53
KDM4E B2RXH2 4/20 0.53
ALDH1A1 P00352 3/20 0.53
ESR1 P03372 2/20 0.53
ADRA2A P08913 2/20 0.53
ADORA3 P0DMS8 2/20 0.53
TACR2 P21452 2/20 0.53
SLC6A2 P23975 2/20 0.53
SLC6A4 P31645 2/20 0.53
SLC6A3 Q01959 2/20 0.53
LMNA P02545 2/20 0.53
SHBG P04278 1/20 0.53
CYP3A4 P08684 1/20 0.53

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
SCHEMBL8218536 1.00 MAPT (0.56) MAPTSMN1; SMN2TP53THRBNPC1
SCHEMBL5831652 0.93 ALDH1A1 (0.54) MAPTSMN1; SMN2TP53THRBNPC1
SCHEMBL8554845 0.92 APP (0.51) MAPTSMN1; SMN2NPC1RAB9AKDM4E
SCHEMBL5946763 0.92 APP (0.51) MAPTSMN1; SMN2NPC1RAB9AKDM4E
SCHEMBL8553099 0.92 APP (0.51) MAPTSMN1; SMN2NPC1RAB9AKDM4E
SCHEMBL8551625 0.91 APP (0.50) MAPTSMN1; SMN2NPC1RAB9AKDM4E
SCHEMBL8428720 0.90 NPC1 (0.56) MAPTSMN1; SMN2TP53THRBNPC1
SCHEMBL5946928 0.88 CASP3 (0.46) MAPTSMN1; SMN2NPC1RAB9AKDM4E
SCHEMBL11335376 0.87 APP (0.63) MAPTSMN1; SMN2TP53THRBNPC1
SCHEMBL8371612 0.86 RARB (0.61) MAPTSMN1; SMN2NPC1RAB9AATM

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
EP-0440061-B1 Mesomorphic compound, liquid crystal composition containing same, liquid crystal device using same and display apparatus CANON KK (JP) 1998-04-01 EP disclosed
US-5284599-A Benzothiazole with alkyl group having asymmetric carbon connected to halogen; improved response CANON KABUSHIKI KAISHA (JP) 1994-02-08 US disclosed
US-5236619-A Benzothiazoles CANON KABUSHIKI KAISHA (JP) 1993-08-17 US disclosed
EP-0440061-A1 Mesomorphic compound, liquid crystal composition containing same, liquid crystal device using same and display apparatus CANON KABUSHIKI KAISHA (JP) 1991-08-07 EP disclosed