SCHEMBL4620129

SCHEMBL4620129

Cc1ccnc2cccc(Cl)c12

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 3/20 0.44
ELANE P08246 2/20 0.41
ALDH1A1 P00352 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2C9 P11712 1/20 0.39
HPGD P15428 1/20 0.39
ALOX15 P16050 1/20 0.39
CYP2C19 P33261 1/20 0.39
HSD17B10 Q99714 1/20 0.39
KDM4E B2RXH2 1/20 0.39
MEN1 O00255 1/20 0.39
MAPT P10636 1/20 0.39
MAPK1 P28482 1/20 0.39
KMT2A Q03164 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
GRIN1 Q05586 2/20 0.36
GRIN2A Q12879 2/20 0.36
ACHE P22303 2/20 0.36
NR4A2 P43354 1/20 0.35
PSMD14 O00487 1/20 0.35

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
SCHEMBL8603889 0.92 PARP1 (0.44) PARP1ELANEALDH1A1CYP1A2CYP2C9
SCHEMBL29404834 0.83 PARP1 (0.50) PARP1ELANEALDH1A1CYP1A2CYP2C9
SCHEMBL6465602 0.83 PARP1 (0.50) PARP1ELANEALDH1A1CYP1A2CYP2C9
SCHEMBL8404515 0.83 ELANE (0.50) PARP1ELANEACHEPSMD14COPS5
SCHEMBL19044153 0.76 PARP1 (0.44) PARP1ELANEALDH1A1HPGDHSD17B10
SCHEMBL21101484 0.76 PARP1 (0.44) PARP1ELANEALDH1A1CYP1A2CYP2C9
SCHEMBL5539377 0.76 MAPT (0.43) PARP1ELANEALDH1A1HPGDALOX15
SCHEMBL15139040 0.76 NR4A2 (0.52) PARP1ALDH1A1CYP1A2CYP2C9HPGD
SCHEMBL4507822 0.76 NCF1 (0.44) PARP1ELANEALDH1A1HSD17B10KDM4E
SCHEMBL5539373 0.76 ELANE (0.44) PARP1ELANEPSMD14COPS5

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021113698-A1 MASP-2 INHIBITORS AND METHODS OF USE OMEROS CORPORATION (US) 2021-06-10 WO disclosed
US-20080124732-A1 METHOD FOR OPTICAL MEASUREMENT OF MULTI-STRANDED NUCLEIC ACID FUJIFILM CORPORATION 2008-05-29 US disclosed
EP-1889880-A2 Method for optical measurement of multi-stranded nucleic acid FUJIFILM Corporation (JP) 2008-02-20 EP disclosed
EP-1362894-B1 Method for optical measurement of multi-stranded nucleic acid using cyanine dyes FUJIFILM CORP (JP) 2007-12-19 EP disclosed
US-20050112770-A1 Method for optical measurement of multi-stranded nucleic acid FUJI PHOTO FILM CO., LTD. 2005-05-26 US disclosed
EP-1362894-A2 Method for optical measurement of multi-stranded nucleic acid using cyanine dyes FUJI PHOTO FILM CO., LTD. (JP) 2003-11-19 EP disclosed