SCHEMBL1738481

SCHEMBL1738481

Cc1ccc(OCc2nccc3c(C)c(C)n(C)c23)c(C)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 5/20 0.40
MAPK1 P28482 3/20 0.40
KDM4E B2RXH2 3/20 0.40
ALDH1A1 P00352 3/20 0.40
GAA P10253 2/20 0.40
MAPT P10636 6/20 0.40
SMN1; SMN2 Q16637 5/20 0.39
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
KMT2A Q03164 2/20 0.38
NFKB1 P19838 1/20 0.38
NFKB2 Q00653 1/20 0.38
RELA Q04206 1/20 0.38
HTT P42858 1/20 0.37
HPGD P15428 2/20 0.36
TSHR P16473 2/20 0.36
LMNA P02545 2/20 0.36
CASP3 P42574 1/20 0.36
SENP8 Q96LD8 1/20 0.36
SENP7 Q9BQF6 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 SCHEMBL1737299 0.99 L3MBTL1 (0.40) L3MBTL1MAPK1KDM4EALDH1A1GAA
SCHEMBL1737412 0.86 L3MBTL1 (0.38) L3MBTL1MAPK1KDM4EALDH1A1GAA
SCHEMBL1739157 0.85 L3MBTL1 (0.39) L3MBTL1MAPK1KDM4EALDH1A1GAA
Hydrochloric Acid SCHEMBL1737144 0.85 L3MBTL1 (0.37) L3MBTL1MAPK1KDM4EALDH1A1GAA
Hydrochloric Acid SCHEMBL1737642 0.84 L3MBTL1 (0.38) L3MBTL1MAPK1KDM4EALDH1A1GAA
SCHEMBL1737431 0.84 L3MBTL1 (0.38) L3MBTL1MAPK1KDM4EALDH1A1GAA
Hydrochloric Acid SCHEMBL1737567 0.83 L3MBTL1 (0.37) L3MBTL1MAPK1KDM4EALDH1A1GAA
SCHEMBL1737014 0.82 L3MBTL1 (0.39) L3MBTL1MAPK1KDM4EMAPTSMN1; SMN2
Hydrochloric Acid SCHEMBL1736511 0.82 L3MBTL1 (0.39) L3MBTL1MAPK1KDM4EMAPTSMN1; SMN2
SCHEMBL1737096 0.82 L3MBTL1 (0.36) L3MBTL1MAPK1GAAMAPTSMN1; SMN2

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