SCHEMBL20134965

SCHEMBL20134965

COc1ccc2onc(C3CCN(C(=O)c4ccc([C@@]5(C(C)C)NC(=O)NC5=O)cc4)CC3)c2c1

nearest known ligand 0.48

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MAPK7 Q13164 11/20 0.44
HTR1A P08908 1/20 0.40
HTR2A P28223 1/20 0.40
ADAM17 P78536 1/20 0.40
LMNA P02545 1/20 0.39

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
SCHEMBL20134967 1.00 MAPK7 (0.44) MAPK7HTR1AHTR2AADAM17LMNA
SCHEMBL20135091 0.89 HTR2A (0.46) HTR1AHTR2ALMNA
SCHEMBL20135282 0.89 HTR2A (0.39) HTR1AHTR2AADAM17
SCHEMBL20135284 0.89 HTR2A (0.39) HTR1AHTR2AADAM17
SCHEMBL20135089 0.89 HTR2A (0.46) HTR1AHTR2ALMNA
SCHEMBL29688909 0.89 HTR2A (0.46) HTR1AHTR2ALMNA
SCHEMBL29688529 0.89 HTR2A (0.39) HTR1AHTR2AADAM17
SCHEMBL20135010 0.84 JAK1 (0.48) HTR2A
SCHEMBL20135007 0.84 JAK1 (0.48) HTR2A
SCHEMBL29689296 0.76 MAPK7 (0.39) MAPK7ADAM17

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 MAPK7 390/4885HTR1A 3996/4885HTR2A 3616/4885
US-10407408-B2 Imide derivatives and use thereof as medicine MMP9, MMP2, MMP1 MAPK7 302/4885HTR1A 4081/4885HTR2A 3803/4885

“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.