SCHEMBL1737474

SCHEMBL1737474

CCn1c(C)c(C)c2ccnc(COc3ccc(Cl)c(Cl)c3)c21

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 3/20 0.38
PTGDR2 Q9Y5Y4 2/20 0.36
MAPT P10636 3/20 0.36
POLB P06746 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
KDM4E B2RXH2 2/20 0.35
CCR4 P51679 1/20 0.35
MAOA P21397 2/20 0.33
HASPIN Q8TF76 1/20 0.33
NPC1 O15118 2/20 0.33
RAB9A P51151 2/20 0.33
HPGD P15428 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
GRM5 P41594 1/20 0.33
MAOB P27338 1/20 0.33
SCN9A Q15858 1/20 0.32
GAA P10253 1/20 0.32
MRGPRX4 Q96LA9 1/20 0.32
MEN1 O00255 1/20 0.32

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 SCHEMBL1737703 0.99 DYRK1A (0.37) DYRK1APTGDR2MAPTPOLBTDP1
SCHEMBL1736127 0.91 DYRK1A (0.40) DYRK1APTGDR2MAPTPOLBTDP1
Hydrochloric Acid SCHEMBL1736588 0.90 DYRK1A (0.39) DYRK1APTGDR2MAPTPOLBTDP1
SCHEMBL1737349 0.87 DYRK1A (0.38) DYRK1AMAPTPOLBTDP1L3MBTL1
SCHEMBL1737469 0.87 DYRK1A (0.50) DYRK1APTGDR2MAPTPOLBTDP1
SCHEMBL1736200 0.87 TSHR (0.36) DYRK1APTGDR2MAPTPOLBTDP1
SCHEMBL1738776 0.87 DYRK1A (0.41) DYRK1APTGDR2MAPTPOLBTDP1
SCHEMBL1739316 0.87 MAOA (0.34) DYRK1APTGDR2MAPTPOLBTDP1
Hydrochloric Acid SCHEMBL1736177 0.86 DYRK1A (0.34) DYRK1APTGDR2MAPTPOLBTDP1
Hydrochloric Acid SCHEMBL1736451 0.86 DYRK1A (0.49) DYRK1APTGDR2MAPTPOLBTDP1

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