SCHEMBL1737515

SCHEMBL1737515

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

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 4/20 0.35
MRGPRX4 Q96LA9 1/20 0.33
SMN1; SMN2 Q16637 5/20 0.33
MAPT P10636 5/20 0.33
LMNA P02545 3/20 0.33
NPC1 O15118 2/20 0.33
RAB9A P51151 2/20 0.33
KMT2A Q03164 2/20 0.33
GAA P10253 1/20 0.33
NFKB1 P19838 1/20 0.33
NFKB2 Q00653 1/20 0.33
RELA Q04206 1/20 0.33
PTPN22 Q9Y2R2 1/20 0.33
TP53 P04637 1/20 0.32
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
HTT P42858 1/20 0.32
HPGD P15428 1/20 0.32
TSHR P16473 1/20 0.32
MAPK1 P28482 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 SCHEMBL1738452 0.99 L3MBTL1 (0.34) L3MBTL1MRGPRX4SMN1; SMN2MAPTLMNA
SCHEMBL1737096 0.87 L3MBTL1 (0.36) L3MBTL1MRGPRX4SMN1; SMN2MAPTLMNA
Hydrochloric Acid SCHEMBL1738273 0.86 L3MBTL1 (0.36) L3MBTL1MRGPRX4SMN1; SMN2MAPTLMNA
SCHEMBL1738032 0.85 LMNA (0.34) SMN1; SMN2MAPTLMNANPC1RAB9A
SCHEMBL1739157 0.85 L3MBTL1 (0.39) L3MBTL1MRGPRX4SMN1; SMN2MAPTLMNA
SCHEMBL1738301 0.84 RAB9A (0.36) L3MBTL1NPC1RAB9AKMT2AALDH1A1
Hydrochloric Acid SCHEMBL1736607 0.84 LMNA (0.34) SMN1; SMN2MAPTLMNANPC1RAB9A
Hydrochloric Acid SCHEMBL1737633 0.84 RAB9A (0.35) L3MBTL1NPC1RAB9AKMT2AALDH1A1
Hydrochloric Acid SCHEMBL1737642 0.84 L3MBTL1 (0.38) L3MBTL1MRGPRX4SMN1; SMN2MAPTLMNA
SCHEMBL1737412 0.83 L3MBTL1 (0.38) L3MBTL1MRGPRX4SMN1; SMN2MAPTLMNA

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 5 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
EP-1784404-A4 PYRROLO[2,3-C]PYRIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF YUHAN CORP (KR) 2009-09-09 EP disclosed
EP-1784404-A1 PYRROLO[2,3-C]PYRIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF Yuhan Corporation (KR) 2007-05-16 EP disclosed
WO-2006025716-A1 PYRROLO[2,3-C]PYRIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF YUHAN CORPORATION (KR) 2006-03-09 WO disclosed