SCHEMBL1738730

SCHEMBL1738730

CCn1c(C)c(C)c2cc(C(=O)N3CCCCC3)nc(N3CCc4ccccc4C3)c21

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
RECQL P46063 1/20 0.43
ALDH1A1 P00352 6/20 0.42
HPGD P15428 5/20 0.42
LMNA P02545 2/20 0.42
GAA P10253 2/20 0.42
MAPK1 P28482 3/20 0.40
TSHR P16473 2/20 0.40
CNR2 P34972 1/20 0.37
MAPT P10636 3/20 0.37
NPSR1 Q6W5P4 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
ALOX15 P16050 1/20 0.37
GRIN2D O15399 1/20 0.37
GRIN3B O60391 1/20 0.37
GRIN1 Q05586 1/20 0.37
GRIN2A Q12879 1/20 0.37
GRIN2B Q13224 1/20 0.37
GRIN2C Q14957 1/20 0.37

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 SCHEMBL1736656 0.99 MEN1 (0.48) MEN1KMT2ARECQLALDH1A1HPGD
SCHEMBL1737695 0.99 MEN1 (0.49) MEN1KMT2ARECQLALDH1A1HPGD
Hydrochloric Acid SCHEMBL1738353 0.98 MEN1 (0.48) MEN1KMT2ARECQLALDH1A1HPGD
SCHEMBL1736999 0.93 MEN1 (0.43) MEN1KMT2ARECQLALDH1A1HPGD
SCHEMBL1739692 0.93 MEN1 (0.48) MEN1KMT2ARECQLALDH1A1HPGD
Hydrochloric Acid SCHEMBL1736544 0.92 MEN1 (0.42) MEN1KMT2ARECQLALDH1A1HPGD
SCHEMBL1738244 0.92 RECQL (0.52) MEN1KMT2ARECQLALDH1A1HPGD
Hydrochloric Acid SCHEMBL1738970 0.92 MEN1 (0.48) MEN1KMT2ARECQLALDH1A1HPGD
Hydrochloric Acid SCHEMBL1737362 0.91 RECQL (0.51) MEN1KMT2ARECQLALDH1A1HPGD
SCHEMBL1737994 0.91 MEN1 (0.47) MEN1KMT2ARECQLALDH1A1HPGD

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