SCHEMBL1739157

SCHEMBL1739157

CCn1c(C)c(C)c2ccnc(COc3ccc(C)cc3C)c21

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 5/20 0.39
SMN1; SMN2 Q16637 6/20 0.36
NPC1 O15118 2/20 0.36
RAB9A P51151 2/20 0.36
KMT2A Q03164 2/20 0.36
NFKB1 P19838 1/20 0.36
NFKB2 Q00653 1/20 0.36
RELA Q04206 1/20 0.36
MAPT P10636 6/20 0.36
LMNA P02545 2/20 0.35
HPGD P15428 2/20 0.35
TSHR P16473 2/20 0.35
MAPK1 P28482 2/20 0.35
CASP3 P42574 1/20 0.35
SENP8 Q96LD8 1/20 0.35
SENP7 Q9BQF6 1/20 0.35
SENP6 Q9GZR1 1/20 0.35
GAA P10253 3/20 0.34
ALDH1A1 P00352 2/20 0.34
MRGPRX4 Q96LA9 1/20 0.34

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 SCHEMBL1737642 0.99 L3MBTL1 (0.38) L3MBTL1SMN1; SMN2NPC1RAB9AKMT2A
SCHEMBL1737412 0.91 L3MBTL1 (0.38) L3MBTL1SMN1; SMN2NPC1RAB9AKMT2A
Hydrochloric Acid SCHEMBL1737144 0.90 L3MBTL1 (0.37) L3MBTL1SMN1; SMN2NPC1RAB9AKMT2A
SCHEMBL1737014 0.87 L3MBTL1 (0.39) L3MBTL1SMN1; SMN2NPC1RAB9AKMT2A
SCHEMBL1737431 0.86 L3MBTL1 (0.38) L3MBTL1SMN1; SMN2NPC1RAB9AKMT2A
SCHEMBL1737096 0.86 L3MBTL1 (0.36) L3MBTL1SMN1; SMN2NPC1RAB9AKMT2A
Hydrochloric Acid SCHEMBL1736511 0.86 L3MBTL1 (0.39) L3MBTL1SMN1; SMN2NPC1RAB9AKMT2A
SCHEMBL1737385 0.85 FABP4 (0.41) L3MBTL1SMN1; SMN2NPC1RAB9AKMT2A
Hydrochloric Acid SCHEMBL1737567 0.85 L3MBTL1 (0.37) L3MBTL1SMN1; SMN2NPC1RAB9AKMT2A
SCHEMBL1736040 0.85 L3MBTL1 (0.36) L3MBTL1SMN1; SMN2NPC1RAB9AKMT2A

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