SCHEMBL4718157

SCHEMBL4718157

COc1ccccc1Cc1cc2cc(Cl)ccc2nc1N

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 1/20 0.49
ALDH1A1 P00352 2/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
ADCY10 Q96PN6 1/20 0.46
TLR8 Q9NR97 2/20 0.44
CSNK1D P48730 1/20 0.43
PRNP P04156 1/20 0.42
PLA2G2A P14555 1/20 0.42
SLC6A2 P23975 1/20 0.42
SLC6A4 P31645 1/20 0.42
SLC6A3 Q01959 1/20 0.42
KCNH2 Q12809 1/20 0.42
KDM4E B2RXH2 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
RXFP1 Q9HBX9 1/20 0.42
DHFR P00374 1/20 0.42
MAPT P10636 2/20 0.41
ADORA3 P0DMS8 1/20 0.41
ADORA2A P29274 1/20 0.41

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
SCHEMBL3197320 0.90 IDO1 (0.49) IDO1ALDH1A1L3MBTL1ADCY10TLR8
SCHEMBL3210074 0.87 TLR8 (0.41) ALDH1A1L3MBTL1TLR8CSNK1DPRNP
SCHEMBL3406203 0.87 GAA (0.50) IDO1ADCY10TLR8PLA2G2ADHFR
SCHEMBL3219290 0.86 PLA2G2A (0.48) IDO1ADCY10TLR8CSNK1DPLA2G2A
SCHEMBL3214978 0.86 TP53 (0.47) ALDH1A1L3MBTL1TLR8CSNK1DKDM4E
SCHEMBL3218795 0.85 TLR8 (0.62) ADCY10TLR8ADORA3ADORA2AADORA1
Hydrochloric Acid SCHEMBL3208543 0.85 TP53 (0.46) ALDH1A1L3MBTL1TLR8CSNK1DKDM4E
SCHEMBL3196286 0.84 TLR8 (0.49) IDO1ALDH1A1ADCY10TLR8KDM4E
SCHEMBL3210319 0.82 DPP4 (0.39) TLR8PRNPPLA2G2AKDM4ESMN1; SMN2
SCHEMBL3220931 0.82 TLR8 (0.43) IDO1L3MBTL1ADCY10TLR8PLA2G2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1917245-A1 HETEROCYCLIC COMPOUNDS AND THEIR USE AS BINDING PARTNERS FOR 5-HT5 RECEPTORS Abbott GmbH & Co. KG (DE) 2008-05-07 EP disclosed
WO-2007022946-A1 HETEROCYCLIC COMPOUNDS AND THEIR USE AS BINDING PARTNERS FOR 5-HT5 RECEPTORS ABBOTT GMBH & CO. KG (DE) 2007-03-01 WO disclosed