SCHEMBL20135612

SCHEMBL20135612

C[C@]1(c2ccc(C(=O)N3CCC(c4noc5cc(F)ccc45)CC3)cc2)NC(=O)NC1=O

nearest known ligand 0.62

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
JAK1 P23458 1/20 0.51
DRD2 P14416 2/20 0.48
SLC6A4 P31645 1/20 0.48
HTR2A P28223 1/20 0.47
ACHE P22303 1/20 0.46

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
SCHEMBL20135614 1.00 JAK1 (0.51) JAK1DRD2SLC6A4HTR2AACHE
SCHEMBL20135010 0.88 JAK1 (0.48) JAK1DRD2HTR2A
SCHEMBL20135007 0.88 JAK1 (0.48) JAK1DRD2HTR2A
SCHEMBL20134795 0.87 JAK1 (0.49) JAK1DRD2SLC6A4HTR2AACHE
SCHEMBL20135671 0.87 JAK1 (0.49) JAK1DRD2SLC6A4HTR2AACHE
SCHEMBL20134797 0.87 JAK1 (0.49) JAK1DRD2SLC6A4HTR2AACHE
SCHEMBL20135091 0.82 HTR2A (0.46) HTR2A
SCHEMBL20135089 0.82 HTR2A (0.46) HTR2A
SCHEMBL29688909 0.82 HTR2A (0.46) HTR2A
SCHEMBL23351594 0.77 ACHE (0.55) JAK1DRD2SLC6A4ACHE

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 6 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 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 JAK1 438/4885DRD2 3408/4885SLC6A4 4748/4885
US-10407408-B2 Imide derivatives and use thereof as medicine MMP9, MMP2, MMP1 JAK1 355/4885DRD2 3522/4885SLC6A4 4698/4885

“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.