SCHEMBL20188094

SCHEMBL20188094

CC(C)COc1cc(CCNS(=O)(=O)CC/C=C/CN2C(=O)NC(=O)[C@H]2C)ccc1F

nearest known ligand 0.40

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
DUT P33316 10/20 0.40
SMN1; SMN2 Q16637 1/20 0.33
MAPT P10636 1/20 0.31
TBXA2R P21731 1/20 0.30
ALDH1A1 P00352 1/20 0.30

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
SCHEMBL20187944 0.86 DUT (0.46) DUTSMN1; SMN2MAPT
SCHEMBL22723280 0.84 DUT (0.56) DUT
SCHEMBL22723279 0.84 DUT (0.56) DUT
SCHEMBL22723278 0.84 DUT (0.56) DUT
SCHEMBL18374403 0.83 DUT (0.40) DUT
SCHEMBL18374399 0.83 DUT (0.40) DUT
SCHEMBL20351381 0.83 DUT (0.40) DUT
SCHEMBL20187797 0.83 DUT (0.40) DUTSMN1; SMN2ALDH1A1
SCHEMBL20201755 0.75 DUT (0.35) DUT
SCHEMBL20201751 0.75 DUT (0.35) DUT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2018098206-A1 HYDANTOIN CONTAINING DEOXYURIDINE TRIPHOSPHATASE INHIBITORS CV6 THERAPEUTICS (NI) LIMITED (GB) 2018-05-31 WO disclosed