SCHEMBL1737997

SCHEMBL1737997

Cc1c(C)n(CC(C)C)c2c(/C=C/c3ccccc3)nccc12

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.44
GLA P06280 4/20 0.44
L3MBTL1 Q9Y468 4/20 0.44
ALDH1A1 P00352 4/20 0.44
NPC1 O15118 3/20 0.44
RAB9A P51151 3/20 0.44
LMNA P02545 3/20 0.44
GAA P10253 2/20 0.44
HTT P42858 1/20 0.44
MAPT P10636 5/20 0.40
MEN1 O00255 4/20 0.40
KMT2A Q03164 4/20 0.40
ATM Q13315 2/20 0.40
NPSR1 Q6W5P4 2/20 0.40
MAPK1 P28482 1/20 0.40
SMN1; SMN2 Q16637 6/20 0.38
POLB P06746 3/20 0.38
GRM4 Q14833 3/20 0.37
TP53 P04637 3/20 0.36
GRM5 P41594 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
SCHEMBL1737998 1.00 KDM4E (0.44) KDM4EGLAL3MBTL1ALDH1A1NPC1
Hydrochloric Acid SCHEMBL1735621 0.99 KDM4E (0.43) KDM4EGLAL3MBTL1ALDH1A1NPC1
Hydrochloric Acid SCHEMBL1735618 0.99 KDM4E (0.43) KDM4EGLAL3MBTL1ALDH1A1NPC1
SCHEMBL1736370 0.87 GLA (0.42) KDM4EGLAL3MBTL1ALDH1A1NPC1
SCHEMBL1736368 0.87 GLA (0.42) KDM4EGLAL3MBTL1ALDH1A1NPC1
Hydrochloric Acid SCHEMBL1737064 0.86 KDM4E (0.41) KDM4EGLAL3MBTL1ALDH1A1NPC1
Hydrochloric Acid SCHEMBL1738068 0.86 KDM4E (0.41) KDM4EGLAL3MBTL1ALDH1A1NPC1
SCHEMBL1738554 0.85 FABP4 (0.47) KDM4EGLAL3MBTL1ALDH1A1NPC1
SCHEMBL1738550 0.85 FABP4 (0.47) KDM4EGLAL3MBTL1ALDH1A1NPC1
Hydrochloric Acid SCHEMBL1736639 0.84 FABP4 (0.46) KDM4EGLAL3MBTL1ALDH1A1NPC1

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