SCHEMBL1736203

SCHEMBL1736203

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

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 2/20 0.35
DYRK1A Q13627 3/20 0.33
MAPT P10636 2/20 0.32
POLB P06746 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
MRGPRX4 Q96LA9 1/20 0.31
MEN1 O00255 1/20 0.31
SLC26A4 O43511 1/20 0.31
KMT2A Q03164 1/20 0.31
HRH3 Q9Y5N1 1/20 0.31
DAO P14920 1/20 0.31
SCN5A Q14524 1/20 0.31
SCN9A Q15858 1/20 0.31
CCR4 P51679 1/20 0.30
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30
LMNA P02545 1/20 0.30
NPC1 O15118 2/20 0.30
RAB9A P51151 2/20 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
Hydrochloric Acid SCHEMBL1736471 0.99 PTGDR2 (0.35) PTGDR2DYRK1AMAPTPOLBTDP1
SCHEMBL1737072 0.89 MAOA (0.33) DYRK1AMAPTTDP1L3MBTL1KDM4E
Hydrochloric Acid SCHEMBL1736258 0.88 MAOB (0.33) DYRK1AMAPTTDP1L3MBTL1KDM4E
SCHEMBL1739316 0.88 MAOA (0.34) PTGDR2DYRK1AMAPTPOLBTDP1
Hydrochloric Acid SCHEMBL1736177 0.87 DYRK1A (0.34) PTGDR2DYRK1AMAPTPOLBTDP1
SCHEMBL1738032 0.86 LMNA (0.34) MAPTMEN1KMT2ALMNANPC1
SCHEMBL1738162 0.85 MAOB (0.34) MAPTMEN1KMT2AALDH1A1LMNA
Hydrochloric Acid SCHEMBL1736607 0.85 LMNA (0.34) MAPTMEN1KMT2ALMNANPC1
SCHEMBL1737474 0.85 DYRK1A (0.38) PTGDR2DYRK1AMAPTPOLBTDP1
Hydrochloric Acid SCHEMBL1736497 0.84 MAOB (0.33) MAPTMEN1KMT2AALDH1A1LMNA

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 5 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
EP-1784404-A4 PYRROLO[2,3-C]PYRIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF YUHAN CORP (KR) 2009-09-09 EP disclosed
EP-1784404-A1 PYRROLO[2,3-C]PYRIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF Yuhan Corporation (KR) 2007-05-16 EP disclosed
WO-2006025716-A1 PYRROLO[2,3-C]PYRIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF YUHAN CORPORATION (KR) 2006-03-09 WO disclosed