SCHEMBL3842414

SCHEMBL3842414

Cc1c(C)n(Cc2ccccc2)c2c(NCc3ccc(F)cc3)nc(C(=O)N3CCOCC3)cc12

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.49
KDM4E B2RXH2 1/20 0.49
CTNNB1 P35222 3/20 0.44
TCF7L2 Q9NQB0 3/20 0.44
MAPK10 P53779 2/20 0.43
KMT2A Q03164 2/20 0.42
MEN1 O00255 1/20 0.42
NTRK1 P04629 2/20 0.41
HTT P42858 1/20 0.41
MAPK8 P45983 1/20 0.41
POLB P06746 1/20 0.40

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 SCHEMBL1736846 0.99 MAPT (0.49) MAPTKDM4ECTNNB1TCF7L2MAPK10
Hydrochloric Acid SCHEMBL1738844 0.91 MEN1 (0.43) MAPTCTNNB1TCF7L2MAPK10KMT2A
SCHEMBL27698535 0.91 CTNNB1 (0.44) MAPTCTNNB1TCF7L2MAPK10KMT2A
Hydrochloric Acid SCHEMBL1737509 0.90 CTNNB1 (0.44) MAPTCTNNB1TCF7L2MAPK10KMT2A
Hydrochloric Acid SCHEMBL1737083 0.89 MEN1 (0.51) MAPTKDM4ECTNNB1TCF7L2MAPK10
SCHEMBL1738141 0.86 MAPT (0.47) MAPTKMT2AHTT
Hydrochloric Acid SCHEMBL1736991 0.85 MAPT (0.46) MAPTKMT2AHTT
SCHEMBL1735914 0.84 MAPT (0.46) MAPTKMT2AHTT
Hydrochloric Acid SCHEMBL1736968 0.84 MAPT (0.45) MAPTKMT2AHTT
SCHEMBL5810293 0.84 HSD17B10 (0.44) MAPTKDM4EKMT2AMEN1HTT

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
CN-101018789-B Pyrrolo[2,3-c]pyridine derivatives and processes for the preparation thereof YUHAN CORP 2010-09-08 CN 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
CN-101018789-A Pyrrolo[2,3-c]pyridine derivatives and processes for the preparation thereof YUHAN CORP (KR) 2007-08-15 CN 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