SCHEMBL4619983

SCHEMBL4619983

Cc1ccnc2cccc(F)c12

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 3/20 0.44
ELANE P08246 2/20 0.41
ACHE P22303 2/20 0.38
TGFBR1 P36897 3/20 0.36
PIK3R2 O00459 1/20 0.36
PSMD14 O00487 1/20 0.35
COPS5 Q92905 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2C8 P10632 1/20 0.35
MBNL1 Q9NR56 1/20 0.35
LRRK2 Q5S007 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
SCHEMBL8404515 0.83 ELANE (0.50) PARP1ELANEACHEPSMD14COPS5
SCHEMBL4618785 0.81 HTT (0.47) PARP1ELANECYP3A4
SCHEMBL22342563 0.76 PARP1 (0.44) PARP1ACHETGFBR1PIK3R2CYP3A4
SCHEMBL22342561 0.76 PARP1 (0.44) PARP1ACHEPIK3R2
SCHEMBL10669377 0.76 NCF1 (0.48) PARP1ACHETGFBR1
SCHEMBL9984695 0.76 PARP1 (0.44) PARP1ELANEACHETGFBR1
SCHEMBL4507822 0.76 NCF1 (0.44) PARP1ELANEACHECYP3A4
SCHEMBL19044153 0.76 PARP1 (0.44) PARP1ELANETGFBR1PSMD14COPS5
SCHEMBL5539373 0.76 ELANE (0.44) PARP1ELANEPSMD14COPS5
SCHEMBL5539377 0.76 MAPT (0.43) PARP1ELANEACHEPSMD14COPS5

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