SCHEMBL20134907

SCHEMBL20134907

Cc1cc(C2CC2)cnc1N1CCN(C(=O)c2ccc(C3(C)NC(=O)NC3=O)cc2F)CC1

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.39
KMT2A Q03164 1/20 0.39
ADAMTS5 Q9UNA0 14/20 0.38
MMP2 P08253 3/20 0.38
KDM4E B2RXH2 1/20 0.37
ADAM17 P78536 2/20 0.35
EGLN1 Q9GZT9 1/20 0.34
CPS1 P31327 1/20 0.34
LMNA P02545 1/20 0.34
MAPT P10636 1/20 0.34
TSHR P16473 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
SCHEMBL29688734 1.00 HTT (0.39) HTTKMT2AADAMTS5MMP2KDM4E
SCHEMBL20135387 1.00 HTT (0.39) HTTKMT2AADAMTS5MMP2KDM4E
SCHEMBL29688225 1.00 HTT (0.39) HTTKMT2AADAMTS5MMP2KDM4E
SCHEMBL20134896 1.00 HTT (0.39) HTTKMT2AADAMTS5MMP2KDM4E
SCHEMBL29688431 1.00 HTT (0.39) HTTKMT2AADAMTS5MMP2KDM4E
SCHEMBL20134765 0.92 ADAM17 (0.36) HTTADAMTS5MMP2KDM4EADAM17
SCHEMBL29688796 0.92 ADAM17 (0.36) HTTADAMTS5MMP2KDM4EADAM17
SCHEMBL29688882 0.92 KMT2A (0.39) HTTKMT2AADAMTS5MMP2KDM4E
SCHEMBL20135663 0.92 KMT2A (0.39) HTTKMT2AADAMTS5MMP2KDM4E
SCHEMBL29688747 0.90 HTT (0.38) HTTKMT2AADAMTS5MMP2KDM4E

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 HTT 3274/4885KMT2A 2568/4885ADAMTS5 23/4885
US-10407408-B2 Imide derivatives and use thereof as medicine MMP9, MMP2, MMP1 HTT 3414/4885KMT2A 2539/4885ADAMTS5 25/4885

“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.