SCHEMBL1735963

SCHEMBL1735963

Cc1c(C)n(C)c2c(CCc3ccccc3)nccc12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.41
ALDH1A1 P00352 8/20 0.37
CYP1A2 P05177 6/20 0.37
CYP2C19 P33261 6/20 0.37
TSHR P16473 5/20 0.37
CYP2C9 P11712 5/20 0.37
CYP3A4 P08684 3/20 0.37
MEN1 O00255 3/20 0.37
KMT2A Q03164 3/20 0.37
MCL1 Q07820 1/20 0.37
HPGD P15428 2/20 0.36
BACE1 P56817 1/20 0.36
MAPK1 P28482 3/20 0.35
LMNA P02545 2/20 0.35
GAA P10253 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
CYP2D6 P10635 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
FABP4 P15090 1/20 0.35
CASP1 P29466 2/20 0.34

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 SCHEMBL1735619 0.99 KDM4E (0.43) KDM4EALDH1A1CYP1A2CYP2C19TSHR
SCHEMBL1737115 0.83 MEN1 (0.41) KDM4EALDH1A1TSHRMEN1KMT2A
SCHEMBL1737696 0.83 FABP4 (0.50) KDM4EALDH1A1CYP1A2CYP2C19TSHR
Hydrochloric Acid SCHEMBL1735614 0.82 MEN1 (0.43) KDM4EALDH1A1MEN1KMT2AMCL1
Hydrochloric Acid SCHEMBL1735464 0.82 FABP4 (0.49) KDM4EALDH1A1CYP1A2CYP2C19TSHR
SCHEMBL1737421 0.81 KDM4E (0.38) KDM4EALDH1A1TSHRMEN1KMT2A
SCHEMBL1739779 0.81 MEN1 (0.50) ALDH1A1CYP1A2CYP2C19TSHRCYP2C9
Hydrochloric Acid SCHEMBL1738010 0.80 KDM4E (0.40) KDM4EALDH1A1TSHRMEN1KMT2A
Hydrochloric Acid SCHEMBL1736472 0.80 MEN1 (0.49) KDM4EALDH1A1CYP1A2CYP2C19TSHR
SCHEMBL1738218 0.79 KDM4E (0.36) KDM4EALDH1A1CYP1A2CYP2C19CYP2C9

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