SCHEMBL1738229

SCHEMBL1738229

Cc1c(C)n(Cc2ccccc2)c2c(CNc3ccc(F)cc3)nccc12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.46
GAA P10253 2/20 0.46
FABP4 P15090 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.39
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
HTT P42858 2/20 0.38
KCNH3 Q9ULD8 2/20 0.38
MCL1 Q07820 1/20 0.38
USP2 O75604 1/20 0.38
LMNA P02545 1/20 0.38
HPGD P15428 1/20 0.38
TSHR P16473 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
POLB P06746 4/20 0.37
ALDH1A1 P00352 1/20 0.37
TP53 P04637 1/20 0.36
DHFR P00374 1/20 0.36

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 SCHEMBL1736638 0.99 MAPT (0.45) MAPTGAAFABP4L3MBTL1NPC1
SCHEMBL1738308 0.91 AURKA (0.44) MAPTGAARAB9AMEN1KMT2A
SCHEMBL1738584 0.91 CCNT1 (0.40) MAPTGAAL3MBTL1LMNAHPGD
Hydrochloric Acid SCHEMBL1736916 0.90 AURKA (0.43) MAPTGAARAB9AMEN1KMT2A
SCHEMBL1738136 0.90 MAPT (0.46) MAPTGAARAB9AMEN1KMT2A
SCHEMBL1737245 0.90 MAPK1 (0.38) MAPTGAAFABP4L3MBTL1RAB9A
Hydrochloric Acid SCHEMBL1735321 0.90 CCNT1 (0.40) MAPTGAAL3MBTL1LMNAHPGD
Hydrochloric Acid SCHEMBL1736171 0.89 MAPT (0.46) MAPTGAARAB9AMEN1KMT2A
Hydrochloric Acid SCHEMBL1737763 0.89 KCNH3 (0.37) MAPTGAAFABP4L3MBTL1RAB9A
SCHEMBL1736713 0.88 PTGDR2 (0.40) MAPTGAATP53

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 2 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