SCHEMBL2768320

SCHEMBL2768320

Cc1[nH]c2c(OCc3ccc(Cl)cc3Cl)cncc2c1C

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
INPPL1 O15357 7/20 0.43
KDM4E B2RXH2 2/20 0.41
ALDH1A1 P00352 1/20 0.41
GAA P10253 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
PTGER1 P34995 2/20 0.39
LMNA P02545 1/20 0.39
MAPT P10636 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
IDO1 P14902 2/20 0.38
NPSR1 Q6W5P4 1/20 0.38
SLC26A4 O43511 1/20 0.38
POLB P06746 1/20 0.38
HDAC8 Q9BY41 2/20 0.38
FABP3 P05413 1/20 0.38
FABP4 P15090 1/20 0.38
FABP5 Q01469 1/20 0.38
MRGPRX4 Q96LA9 1/20 0.37

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 SCHEMBL2769962 0.99 INPPL1 (0.43) INPPL1KDM4EALDH1A1GAATDP1
SCHEMBL2771553 0.83 SMN1; SMN2 (0.40) ALDH1A1LMNAMAPTSMN1; SMN2
Hydrochloric Acid SCHEMBL2770459 0.81 HTT (0.40) ALDH1A1LMNAMAPTSMN1; SMN2
SCHEMBL2769381 0.78 ADRA2A (0.40) KDM4ESLC26A4
SCHEMBL5810331 0.77 CYP1A2 (0.39) INPPL1KDM4EALDH1A1GAATDP1
SCHEMBL3584464 0.77 GAA (0.46) KDM4EALDH1A1GAATDP1PTGER1
Hydrochloric Acid SCHEMBL2769608 0.77 ADRA2A (0.39) SLC26A4
SCHEMBL2771388 0.75 AOC3 (0.49) TDP1LMNAMAPTSMN1; SMN2IDO1
Hydrochloric Acid SCHEMBL2768923 0.74 AOC3 (0.51) ALDH1A1TDP1LMNAMAPTSMN1; SMN2
Hydrochloric Acid SCHEMBL5805941 0.70 IDO1 (0.36) INPPL1KDM4EALDH1A1GAATDP1

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1805177-B9 PYRROLO[3,2-C]PYRIDINE DERIVATIVES AND PROCESS FOR THE PREPARATION THEREOF YUHAN CORP (KR) 2010-09-15 EP claimed
EP-1805177-B1 PYRROLO[3,2-C]PYRIDINE DERIVATIVES AND PROCESS FOR THE PREPARATION THEREOF YUHAN CORP (KR) 2010-04-28 EP claimed
EP-1805177-A4 PYRROLO[3,2-C]PYRIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF YUHAN CORP (KR) 2009-07-29 EP claimed
EP-1805177-A1 PYRROLO[3,2-C]PYRIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF Yuhan Corporation (KR) 2007-07-11 EP claimed
WO-2006025715-A1 PYRROLO[3,2-C]PYRIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF YUHAN CORPORATION (KR) 2006-03-09 WO claimed
EP-1805177-A4 PYRROLO[3,2-C]PYRIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF YUHAN CORP (KR) 2009-07-29 EP disclosed
EP-1805177-A1 PYRROLO[3,2-C]PYRIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF Yuhan Corporation (KR) 2007-07-11 EP disclosed
WO-2006025715-A1 PYRROLO[3,2-C]PYRIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF YUHAN CORPORATION (KR) 2006-03-09 WO disclosed