SCHEMBL1738569

SCHEMBL1738569

Cc1c(C)n(Cc2ccc(F)cc2)c2c(COc3ccc(Cl)c(Cl)c3)nccc12

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 1/20 0.40
PTGDR2 Q9Y5Y4 2/20 0.40
MAPT P10636 5/20 0.38
TP53 P04637 1/20 0.38
MAOB P27338 3/20 0.36
ACHE P22303 1/20 0.36
POLB P06746 1/20 0.35
HRH3 Q9Y5N1 1/20 0.35
CACNA1G O43497 2/20 0.35
KCNH2 Q12809 2/20 0.35
MAOA P21397 2/20 0.35
CYP1A2 P05177 2/20 0.35
CYP3A4 P08684 2/20 0.35
CYP2C9 P11712 2/20 0.35
CYP2C19 P33261 2/20 0.35
KDM4E B2RXH2 1/20 0.35
LMNA P02545 1/20 0.35
TSHR P16473 1/20 0.35
BLM P54132 1/20 0.35
PMP22 Q01453 1/20 0.35

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
Hydrochloric Acid SCHEMBL1735326 0.99 DYRK1A (0.39) DYRK1APTGDR2MAPTTP53MAOB
SCHEMBL1738776 0.93 DYRK1A (0.41) DYRK1APTGDR2MAPTTP53MAOB
Hydrochloric Acid SCHEMBL1736303 0.92 DYRK1A (0.40) DYRK1APTGDR2MAPTTP53MAOB
SCHEMBL1737469 0.91 DYRK1A (0.50) DYRK1APTGDR2MAPTTP53POLB
SCHEMBL1736156 0.90 MAPT (0.42) DYRK1AMAPTTP53MAOBACHE
Hydrochloric Acid SCHEMBL1736451 0.90 DYRK1A (0.49) DYRK1APTGDR2MAPTTP53POLB
Hydrochloric Acid SCHEMBL1736249 0.89 MAPT (0.42) DYRK1AMAPTTP53MAOBPOLB
SCHEMBL1738711 0.88 MAPT (0.41) DYRK1AMAPTTP53POLBCACNA1G
SCHEMBL1738960 0.88 PTGDR2 (0.40) DYRK1APTGDR2MAPTTP53HRH3
Hydrochloric Acid SCHEMBL1736702 0.87 MAPT (0.40) DYRK1AMAPTTP53MAOBCACNA1G

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-1784404-B1 PYRROLO[2,3-C]PYRIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF YUHAN CORP (KR) 2011-11-16 EP claimed
US-20110263306-A1 COMPUTER SYSTEM AND PROGRAM NAMCO BANDAI GAMES INC. (JP) 2011-10-27 US claimed