SCHEMBL8008923

SCHEMBL8008923

CSc1cccc2sc(-c3c(C)c(C)c(C)c(C)c3C)nc12

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ILK Q13418 3/20 0.40
F2RL3 Q96RI0 3/20 0.38
ALDH1A1 P00352 4/20 0.36
APP P05067 1/20 0.35
CYP3A4 P08684 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
MEN1 O00255 3/20 0.32
KMT2A Q03164 3/20 0.32
KDM4E B2RXH2 3/20 0.32
MAPT P10636 2/20 0.32
ATM Q13315 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
GAA P10253 1/20 0.31
GRM5 P41594 1/20 0.31
LMNA P02545 1/20 0.30
ADORA3 P0DMS8 1/20 0.30
ADORA2A P29274 1/20 0.30
ADORA1 P30542 1/20 0.30
CYP1A2 P05177 1/20 0.30
CYP2C9 P11712 1/20 0.30

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
SCHEMBL12109832 0.78 ATM (0.41) F2RL3ALDH1A1CYP3A4TDP1MEN1
SCHEMBL9305886 0.75 MEN1 (0.38) F2RL3ALDH1A1CYP3A4TDP1MEN1
SCHEMBL10448664 0.73 ALDH1A1 (0.60) F2RL3ALDH1A1CYP3A4TDP1MEN1
SCHEMBL3923193 0.73 ALDH1A1 (0.47) F2RL3ALDH1A1CYP3A4TDP1MEN1
SCHEMBL9305704 0.73 ALDH1A1 (0.37) F2RL3ALDH1A1CYP3A4TDP1MEN1
SCHEMBL11709639 0.70 PSMB8 (0.59) ALDH1A1CYP3A4TDP1MEN1KMT2A
SCHEMBL31293857 0.68 ALDH1A1 (0.33) F2RL3ALDH1A1CYP3A4TDP1MEN1
SCHEMBL54176 0.68 PSMB8 (0.36) F2RL3ALDH1A1CYP3A4TDP1MEN1
SCHEMBL11781953 0.66 TLR8 (0.43) ALDH1A1MAPTHPGD
SCHEMBL10759192 0.65 MAPT (0.36) ALDH1A1MEN1KMT2AKDM4EMAPT

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
WO-2000030632-A1 ARYL AND HETEROARYL COMPOUNDS USEFUL AS FIBROBLAST GROWTH FACTOR ANTAGONISTS EISAI CO., LTD. (JP) 2000-06-02 WO claimed