SCHEMBL1738405

SCHEMBL1738405

CCc1c(C)c2ccnc(N3CCc4ccccc4C3)c2n1Cc1ccc(OC)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRMT5 O14744 2/20 0.42
WDR77 Q9BQA1 2/20 0.42
MAPT P10636 4/20 0.41
KDM4E B2RXH2 3/20 0.41
NPSR1 Q6W5P4 3/20 0.41
MAPK1 P28482 2/20 0.41
ALDH1A1 P00352 6/20 0.40
POLB P06746 1/20 0.40
TSHR P16473 3/20 0.40
HPGD P15428 2/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2C9 P11712 1/20 0.40
PKM P14618 1/20 0.40
CYP2C19 P33261 1/20 0.40
HSD17B10 Q99714 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
GRIN2D O15399 2/20 0.38
GRIN3B O60391 2/20 0.38
GRIN1 Q05586 2/20 0.38

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 SCHEMBL1737085 0.99 PRMT5 (0.42) PRMT5WDR77MAPTKDM4ENPSR1
SCHEMBL1739551 0.91 GRIN2D (0.45) PRMT5WDR77MAPTKDM4ENPSR1
SCHEMBL1737479 0.91 ALDH1A1 (0.48) MAPTKDM4ENPSR1MAPK1ALDH1A1
SCHEMBL1737978 0.90 KDM4E (0.41) PRMT5WDR77MAPTKDM4ENPSR1
Hydrochloric Acid SCHEMBL1737821 0.90 GRIN2D (0.44) PRMT5WDR77MAPTKDM4ENPSR1
SCHEMBL1737576 0.90 ALDH1A1 (0.42) PRMT5WDR77MAPTKDM4ENPSR1
SCHEMBL1740044 0.90 MAPT (0.42) PRMT5WDR77MAPTKDM4ENPSR1
Hydrochloric Acid SCHEMBL1738427 0.90 ALDH1A1 (0.48) MAPTKDM4ENPSR1MAPK1ALDH1A1
Hydrochloric Acid SCHEMBL1737612 0.90 KDM4E (0.40) PRMT5WDR77MAPTKDM4ENPSR1
SCHEMBL1736608 0.89 HSD17B10 (0.41) MAPTKDM4ENPSR1MAPK1ALDH1A1

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