SCHEMBL20135018

SCHEMBL20135018

COC1(C2(c3ccc(C(=O)O)cc3)NC(=O)NC2=O)CC1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXRA P19793 12/20 0.38
RXRB P28702 7/20 0.37
RXRG P48443 6/20 0.37
MMP2 P08253 1/20 0.37
MMP3 P08254 1/20 0.37
MMP9 P14780 1/20 0.37
MMP13 P45452 1/20 0.37
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
PDE5A O76074 1/20 0.36
PDE1A P54750 1/20 0.36
PDE1B Q01064 1/20 0.36
PDE4D Q08499 1/20 0.36
PDE7A Q13946 1/20 0.36
PDE1C Q14123 1/20 0.36
PDE3A Q14432 1/20 0.36
AKR1B1 P15121 1/20 0.35
CYP26A1 O43174 2/20 0.35
CYP26B1 Q9NR63 2/20 0.35
CRBN Q96SW2 2/20 0.35

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
SCHEMBL11411411 0.73 CYP2C9 (0.63) CA1CA2AKR1B1CACNA1FALDH1A1
SCHEMBL4308515 0.70 MEN1 (0.55) RXRAMMP2MMP9AKR1B1CACNA1F
SCHEMBL20134880 0.70 MEN1 (0.55) RXRAMMP2MMP9AKR1B1CACNA1F
SCHEMBL20134952 0.69 ADAM17 (0.42) MMP2MMP3MMP9MMP13CA1
SCHEMBL20134918 0.69 CYP2C9 (0.73) MMP2MMP9AKR1B1CRBNCACNA1F
SCHEMBL20134906 0.69 CA1 (0.37) RXRARXRBRXRGMMP2MMP3
SCHEMBL20134924 0.68 ADAMTS5 (0.40) MMP2MMP13
SCHEMBL20135221 0.67 AKR1B1 (0.40) MMP2MMP9CA1CA2AKR1B1
SCHEMBL20134813 0.67 RXRA (0.38) RXRARXRBRXRGMMP2MMP3
SCHEMBL20135025 0.67 ADAM17 (0.44) MMP2MMP3MMP9MMP13ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107922347-B Novel imide derivatives and their use as pharmaceuticals 田边三菱制药株式会社 2022-06-28 CN disclosed
US-10407408-B2 Imide derivatives and use thereof as medicine MITSUBISHI TANABE PHARMA CORPORATION (JP) 2019-09-10 US disclosed
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
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 RXRA 1588/4885RXRB 1460/4885RXRG 1827/4885
US-10407408-B2 Imide derivatives and use thereof as medicine MMP9, MMP2, MMP1 RXRA 1368/4885RXRB 1349/4885RXRG 1624/4885

“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.