SCHEMBL7844403

SCHEMBL7844403

CCc1c(Oc2cc(C)cc(C)c2)[nH]c(=O)n(Cc2cc(F)cc(F)c2)c1=O

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GRIN1 Q05586 3/20 0.37
GRIN2B Q13224 3/20 0.37
ROCK2 O75116 3/20 0.33
KMT2A Q03164 2/20 0.32
GAA P10253 1/20 0.32
ALDH1A1 P00352 4/20 0.32
KDM4E B2RXH2 3/20 0.32
P2RX3 P56373 1/20 0.32
RXFP1 Q9HBX9 1/20 0.31
RECQL P46063 1/20 0.31
HSD17B10 Q99714 1/20 0.31
MEN1 O00255 1/20 0.31
MAPT P10636 1/20 0.31

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
SCHEMBL7847258 0.92 ALDH1A1 (0.34) GRIN1GRIN2BKMT2AALDH1A1KDM4E
SCHEMBL7847762 0.86 TYMS (0.38) KMT2AALDH1A1KDM4EP2RX3HSD17B10
SCHEMBL7837064 0.86 HSD17B10 (0.39) GRIN1GRIN2BROCK2KMT2AALDH1A1
SCHEMBL8189652 0.86 KDM4E (0.45) KMT2AALDH1A1KDM4EP2RX3MEN1
SCHEMBL7845923 0.86 DDR1 (0.35) GRIN1GRIN2BKDM4EMAPT
SCHEMBL7843323 0.83 GRIN1 (0.36) GRIN1GRIN2BROCK2KMT2AALDH1A1
SCHEMBL7847016 0.82 TYMS (0.46) KMT2AALDH1A1KDM4EP2RX3MEN1
SCHEMBL6086259 0.82 GRIN1 (0.37) GRIN1GRIN2BROCK2KMT2AGAA
SCHEMBL7836586 0.81 HSD17B10 (0.51) GRIN1GRIN2BKMT2AALDH1A1KDM4E
SCHEMBL7847304 0.81 GRIN1 (0.44) GRIN1GRIN2BKMT2AMEN1

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-1100786-A1 ANTIVIRAL PYRIMIDINEDIONE DERIVATIVES AND PROCESS FOR THE PREPARATION THEREOF Samjin Pharmaceutical Co., Ltd. (KR) 2001-05-23 EP disclosed
WO-2000061564-A1 ANTIVIRAL PYRIMIDINEDIONE DERIVATIVES AND PROCESS FOR THE PREPARATION THEREOF SAMJIN PHARMACEUTICAL CO., LTD. (KR) 2000-10-19 WO disclosed