SCHEMBL20134975

SCHEMBL20134975

CC(C)(C)OC(=O)N1CCC(N2CCc3cc(Br)cnc32)C1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PIK3CA P42336 4/20 0.46
PIK3R1 P27986 3/20 0.46
FNTA P49354 1/20 0.43
FNTB P49356 1/20 0.43
USP30 Q70CQ3 5/20 0.42
FPR2 P25090 3/20 0.41
IDO1 P14902 1/20 0.41
TDO2 P48775 1/20 0.41
GPR119 Q8TDV5 3/20 0.39
KDM4E B2RXH2 1/20 0.39
MAPT P10636 1/20 0.39
THRB P10828 1/20 0.39
SRC P12931 2/20 0.39
EGFR P00533 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
SCHEMBL20134953 0.88 PIK3CA (0.47) PIK3CAPIK3R1USP30GPR119KDM4E
SCHEMBL23761149 0.83 PIK3CA (0.44) PIK3CAPIK3R1FNTAFNTBUSP30
SCHEMBL26506272 0.83 PIK3CA (0.44) PIK3CAPIK3R1FNTAFNTBUSP30
SCHEMBL28644146 0.82 USP30 (0.45) FNTAFNTBUSP30IDO1TDO2
SCHEMBL28644150 0.82 USP30 (0.45) FNTAFNTBUSP30IDO1TDO2
SCHEMBL20134832 0.81 GPR119 (0.48) PIK3CAPIK3R1FNTAFNTBUSP30
SCHEMBL4106892 0.81 FPR2 (0.46) USP30FPR2GPR119KDM4EMAPT
SCHEMBL25150910 0.78 USP30 (0.42) PIK3CAUSP30FPR2IDO1TDO2
SCHEMBL30400063 0.78 USP30 (0.42) PIK3CAUSP30FPR2IDO1TDO2
SCHEMBL2964825 0.77 CYP11B2 (0.42) FNTAFNTBUSP30

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10407408-B2 Imide derivatives and use thereof as medicine MITSUBISHI TANABE PHARMA CORPORATION (JP) 2019-09-10 US disclosed
US-20190077787-A1 NOVEL IMIDE DERIVATIVES AND USE THEREOF AS MEDICINE MITSUBISHI TANABE PHARMA CORPORATION (JP) 2019-03-14 US disclosed
EP-3321256-A1 NOVEL IMIDE DERIVATIVES AND USE THEREOF AS MEDICINE Mitsubishi Tanabe Pharma Corporation (JP) 2018-05-16 EP 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-20190077787-A1 NOVEL IMIDE DERIVATIVES AND USE THEREOF AS MEDICINE MMP9, MMP10, MMP1 PIK3CA 3049/4885PIK3R1 2023/4885FNTA 3395/4885
US-10407408-B2 Imide derivatives and use thereof as medicine MMP9, MMP2, MMP1 PIK3CA 3145/4885PIK3R1 2393/4885FNTA 3392/4885

“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.