SCHEMBL8623449

SCHEMBL8623449

Cc1cc(OC(=O)c2ccc(OC#N)cc2)ccc1OC(=O)c1ccc(OC#N)cc1

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.45
KDM4E B2RXH2 1/20 0.45
POLB P06746 1/20 0.45
MAPK1 P28482 1/20 0.45
KMT2A Q03164 10/20 0.44
LMNA P02545 1/20 0.44
NR1H4 Q96RI1 1/20 0.41
GBA1 P04062 1/20 0.40
MEN1 O00255 2/20 0.40
TDP1 Q9NUW8 1/20 0.40
GAA P10253 2/20 0.39
HPGD P15428 1/20 0.39

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
SCHEMBL14016851 0.84 KMT2A (0.58) MAPTKDM4EPOLBMAPK1KMT2A
SCHEMBL10042169 0.83 KMT2A (0.61) MAPTPOLBKMT2ALMNAGBA1
SCHEMBL31086840 0.83 KDM4E (0.48) MAPTKDM4EPOLBMAPK1KMT2A
SCHEMBL496061 0.83 KDM4E (0.48) MAPTKDM4EPOLBMAPK1KMT2A
SCHEMBL21101963 0.82 KDM4E (0.40) MAPTKDM4EPOLBMAPK1KMT2A
SCHEMBL8625083 0.82 HSD17B10 (0.52) MAPTKMT2ALMNAMEN1TDP1
SCHEMBL8945658 0.82 HSD17B10 (0.52) MAPTKMT2ALMNAMEN1TDP1
SCHEMBL31086822 0.82 MAPT (0.50) MAPTKDM4EPOLBMAPK1KMT2A
SCHEMBL12154216 0.82 MAPT (0.47) MAPTKDM4EPOLBMAPK1KMT2A
SCHEMBL10449007 0.82 MAPT (0.50) MAPTKDM4EPOLBMAPK1KMT2A

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-0717735-B1 TRIS-(CYANATO)-S-TRIAZINES AND ANISOTROPIC DUROPLASTIC NETWORKS OBTAINED WITH THEM EUROP COMMUNITIES (LU) 1998-06-10 EP claimed
EP-0717735-A1 TRIS-(CYANATO)-S-TRIAZINES AND ANISOTROPIC DUROPLASTIC NETWORKS OBTAINED WITH THEM EUROPÄISCHE WIRTSCHAFTSGEMEINSCHAFT (E.W.G.) (LU) 1996-06-26 EP claimed
WO-1995007268-A1 TRIS-(CYANATO)-S-TRIAZINES AND ANISOTROPIC DUROPLASTIC NETWORKS OBTAINED WITH THEM EUROPÄISCHE WIRTSCHAFTSGEMEINSCHAFT (LU) 1995-03-16 WO claimed