SCHEMBL1737053

SCHEMBL1737053

Cc1c(C)n(CC2CC2)c2c(N3CCc4ccccc4C3)nc(C(=O)N3CCOCC3)cc12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.47
NAPEPLD Q6IQ20 1/20 0.44
KMT2A Q03164 3/20 0.39
MEN1 O00255 2/20 0.39
RECQL P46063 1/20 0.38
ALDH1A1 P00352 5/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
ADRA1A P35348 1/20 0.37
MAPT P10636 4/20 0.36
KDM4E B2RXH2 2/20 0.36
HPGD P15428 2/20 0.36
CASP1 P29466 1/20 0.36
CASP7 P55210 1/20 0.36
HSD17B10 Q99714 1/20 0.36
MDM2 Q00987 1/20 0.36
GAA P10253 2/20 0.36
MAPK1 P28482 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
AKR1C3 P42330 1/20 0.36
BRD4 O60885 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 SCHEMBL1737894 0.99 LMNA (0.46) LMNANAPEPLDKMT2AMEN1RECQL
SCHEMBL1737463 0.92 MEN1 (0.40) LMNANAPEPLDKMT2AMEN1RECQL
SCHEMBL1737933 0.92 MEN1 (0.40) LMNANAPEPLDKMT2AMEN1RECQL
Hydrochloric Acid SCHEMBL1738936 0.91 MEN1 (0.40) LMNANAPEPLDKMT2AMEN1RECQL
Hydrochloric Acid SCHEMBL1736198 0.91 MEN1 (0.40) LMNANAPEPLDKMT2AMEN1RECQL
SCHEMBL1738594 0.90 MEN1 (0.39) LMNANAPEPLDKMT2AMEN1RECQL
Hydrochloric Acid SCHEMBL1737374 0.89 KMT2A (0.39) LMNANAPEPLDKMT2AMEN1RECQL
SCHEMBL1736849 0.89 RECQL (0.48) LMNANAPEPLDKMT2AMEN1RECQL
Hydrochloric Acid SCHEMBL1738955 0.89 RECQL (0.47) LMNAKMT2AMEN1RECQLALDH1A1
SCHEMBL1737850 0.89 MEN1 (0.39) LMNAKMT2AMEN1RECQLALDH1A1

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 4 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-B1 PYRROLO[2,3-C]PYRIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF YUHAN CORP (KR) 2011-11-16 EP disclosed
US-20110263306-A1 COMPUTER SYSTEM AND PROGRAM NAMCO BANDAI GAMES INC. (JP) 2011-10-27 US disclosed