SCHEMBL31147878

SCHEMBL31147878

CCOC(=O)Cn1ccc(-c2ccc(F)c(F)c2)cc1=O

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GRIN2B Q13224 6/20 0.46
GRIN1 Q05586 1/20 0.43
ALDH1A1 P00352 5/20 0.42
KDM4E B2RXH2 2/20 0.42
TSHR P16473 2/20 0.42
MAPK1 P28482 1/20 0.41
GAA P10253 1/20 0.41
HDAC6 Q9UBN7 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
HSD17B10 Q99714 1/20 0.41
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
RAB9A P51151 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
SCHEMBL31147882 0.88 GAA (0.50) GRIN2BALDH1A1KDM4EGAAHDAC6
SCHEMBL31147965 0.81 HDAC6 (0.51) GRIN2BGRIN1HDAC6
SCHEMBL2828598 0.78 ALDH1A1 (0.49) ALDH1A1KDM4ETSHRSMN1; SMN2HSD17B10
SCHEMBL18913971 0.76 GSK3A (0.46) ALDH1A1KDM4ETSHRHSD17B10MEN1
SCHEMBL15919718 0.75 GSK3A (0.45) ALDH1A1KDM4ETSHRSMN1; SMN2HSD17B10
SCHEMBL13837758 0.75 GSK3A (0.45) ALDH1A1KDM4ETSHRHSD17B10MEN1
SCHEMBL15701010 0.75 GSK3A (0.45) ALDH1A1KDM4ETSHRMAPK1SMN1; SMN2
SCHEMBL17020375 0.75 TSHR (0.47) ALDH1A1KDM4ETSHRMAPK1HSD17B10
SCHEMBL16138147 0.75 F11 (0.47) ALDH1A1KDM4ETSHRMAPK1HDAC6
SCHEMBL18602501 0.74 ALDH1A1 (0.47) ALDH1A1KDM4ETSHRMAPK1HDAC6

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-4695240-A2 CYCLIC VINYL SULFONE WRN INHIBITORS Nimbus Wadjet, Inc. (US) 2026-02-18 EP disclosed
WO-2024215923-A2 CYCLIC VINYL SULFONE WRN INHIBITORS NIMBUS WADJET, INC. (US) 2024-10-17 WO disclosed