SCHEMBL20134930

SCHEMBL20134930

Cc1cc(C2CC2)cnc1N1CCN(C(=O)c2ccc([C@@]3(C)NC(=O)NC3=O)cc2)CC1

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SLC6A7 Q99884 1/20 0.38
ALDH1A1 P00352 2/20 0.38
ADAM17 P78536 2/20 0.37
EGLN1 Q9GZT9 1/20 0.37
KDM4E B2RXH2 2/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
MAPK1 P28482 1/20 0.35
CRBN Q96SW2 3/20 0.35
FASN P49327 3/20 0.35
MMP2 P08253 1/20 0.35
ADAMTS5 Q9UNA0 1/20 0.35
SMO Q99835 1/20 0.35
MGLL Q99685 1/20 0.35
NTSR1 P30989 1/20 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
SCHEMBL20134934 1.00 SLC6A7 (0.38) SLC6A7ALDH1A1ADAM17EGLN1KDM4E
SCHEMBL20134765 0.91 ADAM17 (0.36) ALDH1A1ADAM17KDM4EFASNMMP2
SCHEMBL29688796 0.91 ADAM17 (0.36) ALDH1A1ADAM17KDM4EFASNMMP2
SCHEMBL20134908 0.91 SLC6A7 (0.38) SLC6A7ALDH1A1ADAM17EGLN1KDM4E
SCHEMBL29688222 0.91 SLC6A7 (0.38) SLC6A7ALDH1A1ADAM17EGLN1KDM4E
SCHEMBL20134917 0.91 SLC6A7 (0.38) SLC6A7ALDH1A1ADAM17EGLN1KDM4E
SCHEMBL20135138 0.89 SLC6A7 (0.37) SLC6A7ALDH1A1ADAM17EGLN1KDM4E
SCHEMBL29688969 0.89 SLC6A7 (0.37) SLC6A7ALDH1A1ADAM17EGLN1KDM4E
SCHEMBL20135124 0.88 ALDH1A1 (0.37) SLC6A7ALDH1A1ADAM17EGLN1KDM4E
SCHEMBL20135728 0.88 SLC6A7 (0.40) SLC6A7ALDH1A1EGLN1KDM4EMEN1

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 10 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 claimed
US-10407408-B2 Imide derivatives and use thereof as medicine MITSUBISHI TANABE PHARMA CORPORATION (JP) 2019-09-10 US claimed
US-20190077787-A1 NOVEL IMIDE DERIVATIVES AND USE THEREOF AS MEDICINE MITSUBISHI TANABE PHARMA CORPORATION (JP) 2019-03-14 US claimed
EP-3321256-A1 NOVEL IMIDE DERIVATIVES AND USE THEREOF AS MEDICINE Mitsubishi Tanabe Pharma Corporation (JP) 2018-05-16 EP claimed
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 SLC6A7 3698/4885ALDH1A1 584/4885ADAM17 36/4885
US-10407408-B2 Imide derivatives and use thereof as medicine MMP9, MMP2, MMP1 SLC6A7 3473/4885ALDH1A1 610/4885ADAM17 39/4885

“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.