SCHEMBL1738848

SCHEMBL1738848

Cc1c(C)n(CCC(C)C)c2c(-c3ccc(F)cc3)nccc12

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TGFBR1 P36897 1/20 0.36
ALDH1A1 P00352 2/20 0.36
HPGD P15428 2/20 0.36
TSHR P16473 2/20 0.36
KDM4E B2RXH2 1/20 0.36
HSD17B10 Q99714 1/20 0.36
APOBEC3G Q9HC16 1/20 0.36
RAB9A P51151 2/20 0.36
NPC1 O15118 1/20 0.36
LMNA P02545 1/20 0.36
CACNA1B Q00975 1/20 0.35
TP53 P04637 1/20 0.35
MAPT P10636 1/20 0.35
CSNK1D P48730 2/20 0.35
CSNK1E P49674 2/20 0.35
BCHE P06276 1/20 0.34
MAPK14 Q16539 7/20 0.34
KMT2A Q03164 1/20 0.34
MAPK13 O15264 2/20 0.34
MAPK12 P53778 2/20 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 SCHEMBL1737719 0.99 TGFBR1 (0.36) TGFBR1ALDH1A1HPGDTSHRKDM4E
SCHEMBL1739158 0.90 MCL1 (0.35) ALDH1A1HPGDTSHRKDM4ERAB9A
Hydrochloric Acid SCHEMBL1736609 0.89 MCL1 (0.34) ALDH1A1HPGDTSHRKDM4ERAB9A
SCHEMBL1737407 0.89 KDM4E (0.44) TGFBR1ALDH1A1HPGDTSHRKDM4E
SCHEMBL1737532 0.88 TRPC5 (0.36) ALDH1A1HPGDTSHRKDM4EHSD17B10
Hydrochloric Acid SCHEMBL1738122 0.88 KDM4E (0.43) TGFBR1ALDH1A1HPGDTSHRKDM4E
Hydrochloric Acid SCHEMBL1736647 0.87 TRPC5 (0.36) ALDH1A1HPGDTSHRKDM4EHSD17B10
SCHEMBL1737627 0.86 MAPK14 (0.42) TGFBR1ALDH1A1HPGDTSHRKDM4E
SCHEMBL1736958 0.86 DYRK1A (0.39) ALDH1A1HPGDKDM4ERAB9ANPC1
Hydrochloric Acid SCHEMBL1736543 0.85 MAPK14 (0.42) TGFBR1ALDH1A1HPGDTSHRKDM4E

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