SCHEMBL8944546

SCHEMBL8944546

Cc1cc2cc(O)c(O)cc2n1C

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR35 Q9HC97 3/20 0.55
MEN1 O00255 8/20 0.40
KMT2A Q03164 8/20 0.40
KDM4E B2RXH2 7/20 0.40
TDP1 Q9NUW8 1/20 0.40
DAO P14920 1/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
HPGD P15428 6/20 0.36
ALOX15 P16050 6/20 0.36
ALDH1A1 P00352 5/20 0.36
CYP1A2 P05177 3/20 0.36
CYP3A4 P08684 3/20 0.36
CYP2C19 P33261 3/20 0.36
GAA P10253 2/20 0.36
MAPT P10636 2/20 0.36
HSD17B10 Q99714 2/20 0.36
CASP1 P29466 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
CYP2D6 P10635 1/20 0.36

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
SCHEMBL8349495 0.84 GPR35 (0.41) GPR35MEN1KMT2AKDM4ETDP1
SCHEMBL22004332 0.84 ACLY (0.47) GPR35MEN1KMT2AKDM4ETDP1
SCHEMBL17427791 0.83 MEN1 (0.42) MEN1KMT2AKDM4ETDP1NPC1
SCHEMBL862785 0.76 ALDH1A1 (0.39) MEN1KMT2AKDM4ETDP1NPC1
SCHEMBL5246480 0.74 MEN1 (0.45) MEN1KMT2AKDM4ETDP1DAO
SCHEMBL4378545 0.74 MEN1 (0.57) MEN1KMT2AKDM4ETDP1NPC1
SCHEMBL21166602 0.73 MEN1 (0.37) MEN1KMT2AKDM4ETDP1NPC1
SCHEMBL11719401 0.73 MEN1 (0.40) MEN1KMT2AKDM4ETDP1NPC1
SCHEMBL18177589 0.71 MEN1 (0.39) MEN1KMT2AKDM4ETDP1NPC1
SCHEMBL11783996 0.71 GPR35 (1.00) GPR35KDM4EDAOHPGDALDH1A1

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1042393-C Application of indole derivatives in dyeing of keratose fibre as colour OREAL (FR) 1999-03-10 CN claimed
EP-0496653-B1 Use of indol derivatives as coupling agents in dyeing of keratin fibres OREAL (FR) 1995-09-13 EP claimed
CN-1063409-A Indole derivatives is done the application of colour former in the dyeing keratinous fibres process OREAL (FR) 1992-08-12 CN claimed
EP-0496653-A1 Use of indol derivatives as coupling agents in dyeing of keratin fibres L'OREAL (FR) 1992-07-29 EP claimed
CN-1042393-C Application of indole derivatives in dyeing of keratose fibre as colour OREAL (FR) 1999-03-10 CN disclosed
US-5518505-A Compositions and methods for the dyeing of keratinous fibers with oxidation dye precursors, indole derivative couplers and oxidizing agents L'OREAL (FR) 1996-05-21 US disclosed
EP-0496653-B1 Use of indol derivatives as coupling agents in dyeing of keratin fibres OREAL (FR) 1995-09-13 EP disclosed
CN-1063409-A Indole derivatives is done the application of colour former in the dyeing keratinous fibres process OREAL (FR) 1992-08-12 CN disclosed
EP-0496653-A1 Use of indol derivatives as coupling agents in dyeing of keratin fibres L'OREAL (FR) 1992-07-29 EP disclosed