SCHEMBL1737982

SCHEMBL1737982

CC(C)=CCn1c(C)c(C)c2ccnc(CCc3ccccc3)c21

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.37
FABP4 P15090 1/20 0.37
MEN1 O00255 6/20 0.34
KMT2A Q03164 6/20 0.34
RAB9A P51151 5/20 0.34
NPC1 O15118 4/20 0.34
ALDH1A1 P00352 2/20 0.33
CNR2 P34972 1/20 0.33
HPGD P15428 1/20 0.33
MCL1 Q07820 1/20 0.32
DPP4 P27487 5/20 0.32
CHRM1 P11229 2/20 0.32
KCNH2 Q12809 1/20 0.31
NR2F2 P24468 2/20 0.31
P2RX3 P56373 1/20 0.31
TNF P01375 1/20 0.31
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.31
HTT P42858 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31

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 SCHEMBL1737694 0.99 KDM4E (0.39) KDM4EFABP4MEN1KMT2ARAB9A
SCHEMBL1738218 0.86 KDM4E (0.36) KDM4EFABP4MEN1KMT2ARAB9A
Hydrochloric Acid SCHEMBL1738701 0.85 KDM4E (0.38) KDM4EFABP4MEN1KMT2ARAB9A
SCHEMBL1738213 0.83 NPSR1 (0.41) KDM4EFABP4MEN1KMT2ARAB9A
SCHEMBL1738215 0.83 NPSR1 (0.41) KDM4EFABP4MEN1KMT2ARAB9A
SCHEMBL1737115 0.83 MEN1 (0.41) KDM4EFABP4MEN1KMT2ARAB9A
SCHEMBL1737696 0.83 FABP4 (0.50) KDM4EFABP4MEN1KMT2ARAB9A
Hydrochloric Acid SCHEMBL1737889 0.82 NPSR1 (0.40) KDM4EFABP4MEN1KMT2ARAB9A
Hydrochloric Acid SCHEMBL1736879 0.82 NPSR1 (0.40) KDM4EFABP4MEN1KMT2ARAB9A
Hydrochloric Acid SCHEMBL1735614 0.82 MEN1 (0.43) KDM4EFABP4MEN1KMT2ARAB9A

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 6 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 claimed
JP-2008511621-A 2008-04-17 JP claimed
EP-1784404-A1 PYRROLO[2,3-C]PYRIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF Yuhan Corporation (KR) 2007-05-16 EP claimed
WO-2006025716-A1 PYRROLO[2,3-C]PYRIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF YUHAN CORPORATION (KR) 2006-03-09 WO claimed