SCHEMBL20135169

SCHEMBL20135169

Cc1cc(C2(C(C)C)NC(=O)NC2=O)c(O)cc1C(=O)O

nearest known ligand 0.35

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.35
GAA P10253 1/20 0.35
HPGD P15428 1/20 0.35
HSD17B10 Q99714 1/20 0.35
KMT2A Q03164 1/20 0.32
GRM1 Q13255 1/20 0.31
TSHR P16473 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
ADAMTS5 Q9UNA0 2/20 0.30
CSNK2A1 P68400 1/20 0.30
ADAM17 P78536 1/20 0.30
MCL1 Q07820 1/20 0.30

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
SCHEMBL29688586 1.00 KDM4E (0.35) KDM4EGAAHPGDHSD17B10KMT2A
SCHEMBL29688442 0.73 LMNA (0.36) KDM4ESMN1; SMN2ADAMTS5ADAM17
SCHEMBL20134941 0.69 AKR1B1 (0.40) GAAKMT2ATSHRSMN1; SMN2
SCHEMBL20135221 0.69 AKR1B1 (0.40) GAAKMT2ATSHRSMN1; SMN2
SCHEMBL20134939 0.69 AKR1B1 (0.40) GAAKMT2ATSHRSMN1; SMN2
SCHEMBL20135629 0.68 AKR1B1 (0.35) GAAADAMTS5ADAM17
SCHEMBL29688564 0.66 TSHR (0.33) GAATSHRSMN1; SMN2ADAMTS5ADAM17
SCHEMBL3793157 0.65 ALDH1A1 (0.50) KDM4EGAAHPGDHSD17B10GRM1
SCHEMBL19331350 0.64 KDM4E (0.47) KDM4EGAAHPGDHSD17B10GRM1
SCHEMBL20134909 0.64 LMNA (0.49) KDM4EGAAHPGDHSD17B10KMT2A

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 KDM4E 725/4885GAA 1697/4885HPGD 74/4885
US-10407408-B2 Imide derivatives and use thereof as medicine MMP9, MMP2, MMP1 KDM4E 723/4885GAA 1645/4885HPGD 75/4885

“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.