SCHEMBL4650450

SCHEMBL4650450

CCCCCCCCCCCCCCCC(O)(O)OC(=O)CCC(=O)OC(O)(O)CCCCCCCCCCCCCCC

nearest known ligand 0.46

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.46
DGKA P23743 1/20 0.44
MAPT P10636 2/20 0.43
SMPD1 P17405 1/20 0.43
MAPK1 P28482 1/20 0.43
FDPS P14324 8/20 0.42
GGPS1 O95749 5/20 0.42

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
SCHEMBL4650452 0.93 GPR84 (0.48) MAPT
SCHEMBL11619204 0.90 LMNA (0.53) LMNADGKAMAPTMAPK1
SCHEMBL9954028 0.86 LMNA (0.53) LMNADGKAMAPTMAPK1
SCHEMBL28887008 0.84 LMNA (0.47) LMNADGKAMAPTMAPK1
SCHEMBL10797188 0.84 DGKA (0.50) LMNADGKAMAPT
SCHEMBL9452096 0.82 DGKA (0.45) LMNADGKA
SCHEMBL11762836 0.82 DGKA (0.45) LMNADGKA
SCHEMBL17371715 0.80 LPAR3 (0.50) LMNA
SCHEMBL7054538 0.80 DGKA (0.53) LMNADGKAMAPTMAPK1
SCHEMBL2014240 0.80 DGKA (0.53) LMNADGKAMAPTMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0908785-B1 Etch inhibitors in developer for lithographic printing plates AGFA CORP (US) 2008-09-03 EP disclosed
US-5998102-A Etch inhibitors in developer for lithographic printing plates AGFA CORPORATION (US) 1999-12-07 US disclosed
EP-0908785-A2 Etch inhibitors in developer for lithographic printing plates Bayer Corporation (US) 1999-04-14 EP disclosed