SCHEMBL20135552

SCHEMBL20135552

Cc1cnc(N2CCN(C(=O)c3ccc([C@]4(C(C)C)NC(=O)NC4=O)c(C)c3)CC2)c(C)c1

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.37
ADAMTS5 Q9UNA0 6/20 0.37
ADAM17 P78536 4/20 0.37
TSHR P16473 2/20 0.36
CRBN Q96SW2 1/20 0.36
HPGD P15428 2/20 0.36
LMNA P02545 4/20 0.35
SMN1; SMN2 Q16637 3/20 0.35
KDM4E B2RXH2 2/20 0.35
HTT P42858 2/20 0.35
TP53 P04637 1/20 0.35
MAPT P10636 1/20 0.35
NPSR1 Q6W5P4 1/20 0.34

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
SCHEMBL29688455 1.00 ALDH1A1 (0.37) ALDH1A1ADAMTS5ADAM17TSHRCRBN
SCHEMBL29688685 1.00 ALDH1A1 (0.37) ALDH1A1ADAMTS5ADAM17TSHRCRBN
SCHEMBL20134750 1.00 ALDH1A1 (0.37) ALDH1A1ADAMTS5ADAM17TSHRCRBN
SCHEMBL20134751 1.00 ALDH1A1 (0.37) ALDH1A1ADAMTS5ADAM17TSHRCRBN
SCHEMBL29688589 1.00 ALDH1A1 (0.37) ALDH1A1ADAMTS5ADAM17TSHRCRBN
SCHEMBL29688625 0.93 ALDH1A1 (0.36) ALDH1A1ADAMTS5ADAM17CRBNHPGD
SCHEMBL20135433 0.93 ALDH1A1 (0.36) ALDH1A1ADAMTS5ADAM17CRBNHPGD
SCHEMBL20135123 0.91 LMNA (0.44) ALDH1A1ADAMTS5ADAM17TSHRLMNA
SCHEMBL20135127 0.91 LMNA (0.44) ALDH1A1ADAMTS5ADAM17TSHRLMNA
SCHEMBL20135401 0.91 LMNA (0.44) ALDH1A1ADAMTS5ADAM17TSHRLMNA

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
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 ALDH1A1 584/4885ADAMTS5 23/4885ADAM17 36/4885
US-10407408-B2 Imide derivatives and use thereof as medicine MMP9, MMP2, MMP1 ALDH1A1 610/4885ADAMTS5 25/4885ADAM17 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.