SCHEMBL20135518

SCHEMBL20135518

Cc1ccc(OC2CCN(C(=O)c3ccc(C4(C(C)C)NC(=O)NC4=O)cc3)CC2)nc1

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 9/20 0.38
NAMPT P43490 2/20 0.37
CCNK O75909 1/20 0.37
CDK12 Q9NYV4 1/20 0.37
MMP2 P08253 1/20 0.36
MMP9 P14780 1/20 0.36
CRBN Q96SW2 2/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36

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
SCHEMBL20135516 1.00 HRH3 (0.38) HRH3NAMPTCCNKCDK12MMP2
SCHEMBL29688343 1.00 HRH3 (0.38) HRH3NAMPTCCNKCDK12MMP2
SCHEMBL20134899 0.86 KMT2A (0.46) HRH3MMP2MMP9MEN1KMT2A
SCHEMBL29688787 0.84 CCNK (0.49) CCNKCDK12CRBN
SCHEMBL20135102 0.84 CCNK (0.49) CCNKCDK12CRBN
SCHEMBL20135100 0.84 CCNK (0.49) CCNKCDK12CRBN
SCHEMBL20134863 0.83 ADAM17 (0.40) CCNKCDK12MMP2MMP9CRBN
SCHEMBL20134861 0.83 ADAM17 (0.40) CCNKCDK12MMP2MMP9CRBN
SCHEMBL20135176 0.83 ADAM17 (0.40) CCNKCDK12MMP2MMP9CRBN
SCHEMBL29688786 0.83 ADAM17 (0.40) CCNKCDK12MMP2MMP9CRBN

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 HRH3 1104/4885NAMPT 1506/4885CCNK 2686/4885
US-10407408-B2 Imide derivatives and use thereof as medicine MMP9, MMP2, MMP1 HRH3 1343/4885NAMPT 1633/4885CCNK 2435/4885

“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.