SCHEMBL1735949

SCHEMBL1735949

Cc1c(C)n(CC2CO2)c2c(-c3ccc(Cl)cc3)nccc12

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIN2B Q13224 1/20 0.36
ALDH1A1 P00352 6/20 0.36
HPGD P15428 2/20 0.36
LMNA P02545 2/20 0.36
HTT P42858 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
DRD4 P21917 3/20 0.34
DRD3 P35462 3/20 0.34
DRD2 P14416 2/20 0.34
IDO1 P14902 1/20 0.34
TDO2 P48775 1/20 0.34
APOBEC3G Q9HC16 1/20 0.34
CYP1A2 P05177 5/20 0.33
HSD17B10 Q99714 4/20 0.33
CYP3A4 P08684 3/20 0.33
USP2 O75604 3/20 0.33
CASP1 P29466 3/20 0.33
CASP7 P55210 3/20 0.33
CYP2D6 P10635 2/20 0.33
TSHR P16473 2/20 0.33

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 SCHEMBL1737825 0.99 GRIN2B (0.36) GRIN2BALDH1A1HPGDLMNAHTT
SCHEMBL1737411 0.88 MAPK14 (0.42) GRIN2BALDH1A1HPGDNPSR1CYP1A2
Hydrochloric Acid SCHEMBL1735602 0.87 MAPK14 (0.42) GRIN2BALDH1A1HPGDNPSR1CYP1A2
SCHEMBL1737149 0.87 MERTK (0.38) DRD4DRD3DRD2IDO1TDO2
SCHEMBL1738207 0.86 ACHE (0.40) ALDH1A1HPGDHTTCYP1A2HSD17B10
Hydrochloric Acid SCHEMBL1736821 0.86 MERTK (0.37) DRD4DRD3DRD2IDO1TDO2
Hydrochloric Acid SCHEMBL1736379 0.85 ACHE (0.39) ALDH1A1HPGDHTTCYP1A2HSD17B10
SCHEMBL1737275 0.85 ALOX5 (0.37) GRIN2BDRD4DRD3DRD2IDO1
Hydrochloric Acid SCHEMBL1736645 0.84 ALOX5 (0.36) GRIN2BDRD4DRD3DRD2IDO1
SCHEMBL1737433 0.82 LMNA (0.40) ALDH1A1HPGDLMNANPSR1DRD4

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