SCHEMBL21001067

SCHEMBL21001067

CC(C)(C)OC(=O)N1CC(c2ccc(C(=O)NO)cc2)C1

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 8/20 0.54
HDAC8 Q9BY41 6/20 0.54
HDAC1 Q13547 6/20 0.54
USP30 Q70CQ3 2/20 0.49
KMT2A Q03164 2/20 0.47
RORC P51449 1/20 0.46
HDAC3 O15379 2/20 0.46
HDAC11 Q96DB2 2/20 0.46
PDE4B Q07343 2/20 0.45
NAMPT P43490 2/20 0.44
KDM4E B2RXH2 2/20 0.44
PKM P14618 1/20 0.44
MEN1 O00255 1/20 0.43

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
SCHEMBL21381617 0.87 PDE4B (0.43) USP30KMT2ARORCPDE4BNAMPT
SCHEMBL8053119 0.85 PDE4B (0.48) HDAC6HDAC1USP30KMT2ARORC
SCHEMBL15376005 0.85 RORC (0.49) USP30KMT2ARORCPDE4BNAMPT
SCHEMBL570083 0.83 GPR119 (0.56) USP30KMT2ARORCPDE4BNAMPT
SCHEMBL21381667 0.83 RORC (0.53) RORCPDE4BNAMPTKDM4E
SCHEMBL15187965 0.83 RORC (0.56) USP30RORCPDE4BNAMPTKDM4E
SCHEMBL23119769 0.82 RORC (0.44) USP30KMT2ARORCPDE4BNAMPT
SCHEMBL20607546 0.81 RORC (0.48) RORCPDE4BNAMPTKDM4E
SCHEMBL17736163 0.81 GPR119 (0.53) KMT2ARORCPDE4BNAMPTKDM4E
SCHEMBL23091747 0.81 NAMPT (0.51) RORCPDE4BNAMPTKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3713936-B1 SUBSTITUTED TRIFLUOROMETHYLOXADIAZOLES FOR COMBATING PHYTOPATHOGENIC FUNGI BASF SE (DE) 2021-10-20 EP disclosed
US-11147275-B2 Substituted trifluoromethyloxadiazoles for combating phytopathogenic fungi BASF SE (DE) 2021-10-19 US disclosed
US-20200315177-A1 SUBSTITUTED TRIFLUOROMETHYLOXADIAZOLES FOR COMBATING PHYTOPATHOGENIC FUNGI BASF SE (DE) 2020-10-08 US disclosed
EP-3713936-A1 SUBSTITUTED TRIFLUOROMETHYLOXADIAZOLES FOR COMBATING PHYTOPATHOGENIC FUNGI BASF SE (DE) 2020-09-30 EP disclosed
WO-2019101511-A1 SUBSTITUTED TRIFLUOROMETHYLOXADIAZOLES FOR COMBATING PHYTOPATHOGENIC FUNGI BASF SE (DE) 2019-05-31 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-11147275-B2 Substituted trifluoromethyloxadiazoles for combating phytopathogenic fungi CYP51A1, ERG28, PAOX HDAC6 631/4885HDAC8 3012/4885HDAC1 1923/4885
US-20200315177-A1 SUBSTITUTED TRIFLUOROMETHYLOXADIAZOLES FOR COMBATING PHYTOPATHOGENIC FUNGI CYP51A1, ERG28, PAOX HDAC6 631/4885HDAC8 3012/4885HDAC1 1923/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.