SCHEMBL1737109

SCHEMBL1737109

Cc1c(C)n(CCC(C)C)c2c(N3CCc4ccccc4C3)nccc12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.46
GRIN2D O15399 7/20 0.43
GRIN3B O60391 7/20 0.43
GRIN1 Q05586 7/20 0.43
GRIN2A Q12879 7/20 0.43
GRIN2B Q13224 7/20 0.43
GRIN2C Q14957 7/20 0.43
GRIN3A Q8TCU5 7/20 0.43
KDM4E B2RXH2 3/20 0.42
MAPT P10636 3/20 0.42
HTT P42858 2/20 0.42
ALDH1A1 P00352 2/20 0.42
HPGD P15428 2/20 0.42
TSHR P16473 2/20 0.42
HSD17B10 Q99714 2/20 0.42
RAB9A P51151 1/20 0.42
GLA P06280 1/20 0.42
MAPK1 P28482 1/20 0.42
CASP1 P29466 1/20 0.42
CASP7 P55210 1/20 0.42

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 SCHEMBL1736896 0.99 LMNA (0.45) LMNAGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL1739443 0.92 GRIN2D (0.41) LMNAGRIN2DGRIN3BGRIN1GRIN2A
Hydrochloric Acid SCHEMBL1736985 0.91 GRIN2D (0.41) LMNAGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL1737213 0.90 GRIN2D (0.45) LMNAGRIN2DGRIN3BGRIN1GRIN2A
Hydrochloric Acid SCHEMBL1736643 0.89 GRIN2D (0.44) LMNAGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL1739032 0.88 GRIN2D (0.45) LMNAGRIN2DGRIN3BGRIN1GRIN2A
Hydrochloric Acid SCHEMBL1737351 0.87 GRIN2D (0.44) LMNAGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL1736734 0.86 GRIN2D (0.44) LMNAGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL1738304 0.86 GRIN2D (0.47) LMNAGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL1737602 0.85 GRIN2D (0.43) LMNAGRIN2DGRIN3BGRIN1GRIN2A

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