SCHEMBL23735207

SCHEMBL23735207

CC(C)(C)OC(=O)NCc1cc(F)ccc1O

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
EGFR P00533 1/20 0.44
KDM4A O75164 1/20 0.44
HDAC1 Q13547 1/20 0.43
ANO1 Q5XXA6 4/20 0.43
GRM2 Q14416 1/20 0.43
NQO2 P16083 1/20 0.41
KCNA5 P22460 1/20 0.40
RPS6KA1 Q15418 1/20 0.40
GPR119 Q8TDV5 1/20 0.40
CTSS P25774 2/20 0.39
CTSK P43235 2/20 0.39
BRD4 O60885 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
SCHEMBL1654680 0.90 KDM4A (0.45) KDM4AHDAC1ANO1GRM2NQO2
SCHEMBL27669311 0.84 GRM2 (0.47) KDM4AGRM2KCNA5RPS6KA1GPR119
SCHEMBL29555276 0.84 KDM4A (0.43) KDM4AGRM2NQO2KCNA5RPS6KA1
SCHEMBL23105713 0.84 KDM4A (0.43) KDM4AGRM2NQO2KCNA5RPS6KA1
SCHEMBL2443309 0.84 GRM2 (0.44) KDM4AHDAC1GRM2NQO2KCNA5
SCHEMBL12791296 0.84 P2RX7 (0.46) KDM4AHDAC1GRM2KCNA5RPS6KA1
SCHEMBL29952911 0.83 KDM4A (0.42) KDM4AGRM2NQO2KCNA5RPS6KA1
SCHEMBL29076078 0.83 KCNQ4 (0.47) KDM4AHDAC1GRM2KCNA5RPS6KA1
SCHEMBL4508520 0.83 GPR119 (0.43) KDM4AGRM2KCNA5RPS6KA1GPR119
SCHEMBL27669478 0.83 GRM2 (0.43) KDM4AGRM2NQO2KCNA5RPS6KA1

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
EP-3464249-B1 SUBSTITUTED CARBONUCLEOSIDE DERIVATIVES USEFUL AS ANTICANCER AGENTS PFIZER (US) 2021-08-11 EP disclosed