SCHEMBL328261

SCHEMBL328261

CCC1(c2cc(F)c(F)cc2C)C(=O)N(CC(=O)Nc2ccccc2F)c2cccc(-c3cncnc3)c21

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
POLB P06746 4/20 0.44
TSHR P16473 1/20 0.44
TP53 P04637 2/20 0.43
THRB P10828 2/20 0.39
MAPT P10636 5/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38

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
SCHEMBL10289270 0.85 POLB (0.47) POLBTSHRTP53THRBMAPT
SCHEMBL281987 0.72 POLB (0.40) POLBTSHRTP53THRBMAPT
SCHEMBL19562199 0.65 POLB (0.49) POLBTSHRTHRBMAPTMEN1
SCHEMBL281805 0.64 SCN9A (0.61) POLBTSHRTP53THRBMEN1
SCHEMBL280850 0.62 SCN9A (0.46) POLBTP53THRB
SCHEMBL280798 0.61 POLB (0.47) POLBTSHRTP53THRBMAPT
SCHEMBL280676 0.59 SCN9A (0.58) POLBTSHRTHRBMAPT
SCHEMBL2305385 0.59 SCN9A (0.53) POLBTSHRTP53THRB
SCHEMBL9135817 0.57 POLB (0.69) POLBTSHRTP53MAPTMEN1
SCHEMBL1063418 0.57 NPSR1 (0.71) POLBTSHRMAPT

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-2428515-A1 Spiro-oxindole compounds and their uses as therapeutic agents Xenon Pharmaceuticals Inc. (CA) 2012-03-14 EP disclosed
EP-1888595-B1 SPIRO-OXINDOLE COMPOUNDS AND THEIR USES AS THERAPEUTIC AGENTS XENON PHARMACEUTICALS INC (CA) 2012-02-01 EP disclosed