SCHEMBL6235370

SCHEMBL6235370

Fc1cccc(Cc2n[c]cs2)c1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.42
AGXT P21549 2/20 0.42
TAAR1 Q96RJ0 3/20 0.40
MAPT P10636 2/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
LMNA P02545 1/20 0.38
HPGD P15428 1/20 0.38
DAO P14920 1/20 0.38
HCAR2 Q8TDS4 1/20 0.38
IDH1 O75874 1/20 0.38
GPR52 Q9Y2T5 1/20 0.37
TP53 P04637 1/20 0.36
MAOB P27338 2/20 0.36
P2RX7 Q99572 1/20 0.36
MIF P14174 1/20 0.36
FFAR1 O14842 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
SCHEMBL6232418 0.81 LTA4H (0.43) IDO1TAAR1MAPTMEN1KMT2A
SCHEMBL2093905 0.80 RAB9A (0.38) IDO1AGXTTAAR1MAPTALDH1A1
SCHEMBL6233676 0.77 IDO1 (0.47) IDO1AGXTTAAR1IDH1GPR52
SCHEMBL3300303 0.72 TAAR1 (0.60) IDO1AGXTTAAR1ALDH1A1DAO
SCHEMBL6238401 0.70 IDO1 (0.39) IDO1TAAR1MEN1KMT2AKDM4E
SCHEMBL2091553 0.69 ALDH1A1 (0.46) IDO1AGXTMAPTKMT2AKDM4E
SCHEMBL2095762 0.69 LTA4H (0.39) IDO1AGXTTAAR1MAPTMEN1
SCHEMBL2095241 0.69 LTA4H (0.43) IDO1TAAR1KDM4EALDH1A1IDH1
SCHEMBL694798 0.68 KDM4E (0.47) IDO1TAAR1MAPTMEN1KMT2A
SCHEMBL205608 0.68 TAAR1 (0.40) IDO1AGXTTAAR1MAPTMEN1

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
WO-2005005382-A2 COMPOUNDS, COMPOSITIONS AND METHODS CYTOKINETICS, INC. (US) 2005-01-20 WO claimed
WO-2005005382-A2 COMPOUNDS, COMPOSITIONS AND METHODS CYTOKINETICS, INC. (US) 2005-01-20 WO disclosed