SCHEMBL1736040

SCHEMBL1736040

Cc1ccc(OCc2nccc3c(C)c(C)n(CC4CC4)c23)c(C)c1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 4/20 0.36
SMN1; SMN2 Q16637 4/20 0.34
RAB9A P51151 4/20 0.33
KMT2A Q03164 4/20 0.33
LMNA P02545 3/20 0.33
NPC1 O15118 3/20 0.33
HPGD P15428 2/20 0.33
NFKB1 P19838 1/20 0.33
NFKB2 Q00653 1/20 0.33
RELA Q04206 1/20 0.33
GRIN1 Q05586 1/20 0.33
GRIN2B Q13224 1/20 0.33
MAPT P10636 4/20 0.33
NPY1R P25929 1/20 0.33
HSP90AA1 P07900 1/20 0.32
UBE2N P61088 1/20 0.32
MEN1 O00255 2/20 0.32
TSHR P16473 1/20 0.32
MAPK1 P28482 1/20 0.32
CASP3 P42574 1/20 0.32

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 SCHEMBL1736759 0.99 L3MBTL1 (0.35) L3MBTL1SMN1; SMN2RAB9AKMT2ALMNA
SCHEMBL1739157 0.85 L3MBTL1 (0.39) L3MBTL1SMN1; SMN2RAB9AKMT2ALMNA
SCHEMBL1736197 0.84 KDM4E (0.35) SMN1; SMN2RAB9AKMT2ALMNANPC1
Hydrochloric Acid SCHEMBL1737642 0.84 L3MBTL1 (0.38) L3MBTL1SMN1; SMN2RAB9AKMT2ALMNA
SCHEMBL1737090 0.84 RAB9A (0.39) RAB9AKMT2ALMNANPC1GRIN1
Hydrochloric Acid SCHEMBL1738059 0.84 KDM4E (0.35) SMN1; SMN2RAB9AKMT2ALMNANPC1
SCHEMBL1737412 0.84 L3MBTL1 (0.38) L3MBTL1SMN1; SMN2RAB9AKMT2ALMNA
Hydrochloric Acid SCHEMBL1736424 0.83 RAB9A (0.39) RAB9AKMT2ALMNANPC1GRIN1
Hydrochloric Acid SCHEMBL1737144 0.83 L3MBTL1 (0.37) L3MBTL1SMN1; SMN2RAB9AKMT2ALMNA
SCHEMBL1737014 0.83 L3MBTL1 (0.39) L3MBTL1SMN1; SMN2RAB9AKMT2ALMNA

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