SCHEMBL1735942

SCHEMBL1735942

Cc1c(C)n(Cc2ccccc2)c2c(COc3ccc(Cl)cc3)nccc12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 1/20 0.47
MAPT P10636 1/20 0.45
RECQL P46063 1/20 0.44
FABP4 P15090 1/20 0.44
CYP19A1 P11511 2/20 0.43
ADAMTS5 Q9UNA0 2/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
KDM4E B2RXH2 1/20 0.41
ALOX15 P16050 1/20 0.41
TSHR P16473 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
TP53 P04637 2/20 0.40
GAA P10253 2/20 0.40
NPSR1 Q6W5P4 1/20 0.40
MEN1 O00255 1/20 0.39
NR2F2 P24468 1/20 0.39
KMT2A Q03164 1/20 0.39
ALDH1A1 P00352 1/20 0.39
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38

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 SCHEMBL1736539 0.99 DYRK1A (0.47) DYRK1AMAPTRECQLFABP4CYP19A1
SCHEMBL1737080 0.92 DYRK1A (0.48) DYRK1AMAPTFABP4CYP19A1L3MBTL1
SCHEMBL1736377 0.91 MAPT (0.41) DYRK1AMAPTADAMTS5KDM4ETP53
SCHEMBL1737387 0.91 MAPT (0.41) DYRK1AMAPTADAMTS5KDM4ETP53
Hydrochloric Acid SCHEMBL1735387 0.91 DYRK1A (0.47) DYRK1AMAPTFABP4CYP19A1L3MBTL1
SCHEMBL1735940 0.91 DYRK1A (0.47) DYRK1AMAPTFABP4CYP19A1L3MBTL1
SCHEMBL1738711 0.90 MAPT (0.41) DYRK1AMAPTADAMTS5KDM4ETP53
Hydrochloric Acid SCHEMBL1737634 0.90 MAPT (0.40) DYRK1AMAPTADAMTS5KDM4ETP53
Hydrochloric Acid SCHEMBL1737746 0.90 MAPT (0.40) DYRK1AMAPTADAMTS5KDM4ETP53
Hydrochloric Acid SCHEMBL1736586 0.90 DYRK1A (0.47) DYRK1AMAPTFABP4CYP19A1L3MBTL1

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