SCHEMBL9780220

SCHEMBL9780220

CCNS(=O)(=O)CCNc1ccc(OC(F)(F)F)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.50
KIF11 P52732 1/20 0.48
LMNA P02545 1/20 0.46
EPHX2 P34913 2/20 0.43
TP53 P04637 1/20 0.43
HTT P42858 2/20 0.42
MAPT P10636 2/20 0.42
MEN1 O00255 1/20 0.42
RAB9A P51151 1/20 0.42
KMT2A Q03164 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
ATM Q13315 1/20 0.41
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA7 P43166 1/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
KDM4E B2RXH2 2/20 0.40
ALDH1A1 P00352 2/20 0.40
TDP1 Q9NUW8 1/20 0.40

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
SCHEMBL9780309 0.85 KIF11 (0.50) POLBKIF11LMNAEPHX2TP53
SCHEMBL9780212 0.80 KIF11 (0.50) POLBKIF11LMNAEPHX2TP53
SCHEMBL9780344 0.79 CA1 (0.50) POLBKIF11EPHX2TP53HTT
SCHEMBL18571409 0.79 MMP1 (0.46) POLBKIF11LMNAEPHX2MEN1
SCHEMBL747450 0.78 POLB (0.59) POLBKIF11LMNAEPHX2TP53
SCHEMBL6233494 0.76 POLB (0.58) POLBKIF11LMNAEPHX2HTT
SCHEMBL24767382 0.75 KIF11 (0.64) POLBKIF11LMNAEPHX2HTT
SCHEMBL22816428 0.73 KIF11 (0.57) POLBKIF11LMNAEPHX2HTT
SCHEMBL13565289 0.72 GRIA1 (0.51) POLBKIF11EPHX2HTTMAPT
SCHEMBL11935543 0.72 KIF11 (0.46) POLBKIF11LMNAEPHX2TP53

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
US-5026717-A Glutamate inhibitors RHONE-POULENC SANTE (FR) 1991-06-25 US disclosed
US-4980356-A ANTICONVULSANTS; ANTISPASMODIC AGENTS; MUSCULAR AND NERVOUS SYSTEMS DISORDERS RHONE-POULENC SANTE (FR) 1990-12-25 US disclosed