SCHEMBL1737253

SCHEMBL1737253

CCn1c(C)c(C)c2ccnc(COc3ccc(F)cc3)c21

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 1/20 0.38
NPC1 O15118 3/20 0.37
RAB9A P51151 3/20 0.37
MAPT P10636 4/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
CYP1A2 P05177 2/20 0.35
CYP3A4 P08684 2/20 0.35
CYP2D6 P10635 2/20 0.35
CYP2C19 P33261 2/20 0.35
CYP2C9 P11712 1/20 0.35
MAOB P27338 2/20 0.34
MAOA P21397 1/20 0.34
GRM5 P41594 2/20 0.34
FFAR1 O14842 1/20 0.34
HASPIN Q8TF76 1/20 0.33
CACNA2D1 P54289 1/20 0.33
APP P05067 1/20 0.33
HTT P42858 1/20 0.33
NCOA3 Q9Y6Q9 1/20 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 SCHEMBL1736373 0.99 DYRK1A (0.38) DYRK1ANPC1RAB9AMAPTMEN1
SCHEMBL1739295 0.91 RAB9A (0.45) DYRK1ANPC1RAB9AMAPTMEN1
SCHEMBL1737404 0.90 DYRK1A (0.40) DYRK1ANPC1RAB9AMAPTCYP1A2
Hydrochloric Acid SCHEMBL1737677 0.90 RAB9A (0.44) DYRK1ANPC1RAB9AMAPTMEN1
Hydrochloric Acid SCHEMBL1737655 0.89 DYRK1A (0.40) DYRK1ANPC1RAB9AMAPTCYP1A2
SCHEMBL1737349 0.89 DYRK1A (0.38) DYRK1ANPC1RAB9AMAPTMEN1
SCHEMBL1736156 0.88 MAPT (0.42) DYRK1AMAPTMEN1KMT2ACYP1A2
Hydrochloric Acid SCHEMBL1737392 0.88 DYRK1A (0.37) DYRK1ANPC1RAB9AMAPTMEN1
Hydrochloric Acid SCHEMBL1736249 0.86 MAPT (0.42) DYRK1AMAPTMEN1KMT2ACYP1A2
SCHEMBL1737110 0.85 NPC1 (0.38) NPC1RAB9AMAPTCYP1A2CYP3A4

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