SCHEMBL30609686

SCHEMBL30609686

C[C@H]1CNCCN1c1cc(Cl)cc(Cl)n1

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 10/20 0.48
MMP2 P08253 1/20 0.41
ADAMTS5 Q9UNA0 1/20 0.41
GSK3B P49841 4/20 0.39
HTR2A P28223 4/20 0.39
HTR2B P41595 3/20 0.39
LATS1 O95835 1/20 0.39
PIM1 P11309 2/20 0.38
PIM3 Q86V86 2/20 0.38
PIM2 Q9P1W9 2/20 0.38
SPAST Q9UBP0 1/20 0.38

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
SCHEMBL17884815 1.00 HTR2C (0.48) HTR2CMMP2ADAMTS5GSK3BHTR2A
SCHEMBL5585636 0.83 HTR2C (0.46) HTR2CGSK3BHTR2AHTR2B
SCHEMBL19759016 0.80 GSK3B (0.41) HTR2CADAMTS5GSK3BHTR2AHTR2B
SCHEMBL9213161 0.79 HTR3E (0.56) HTR2CGSK3BHTR2AHTR2BPIM1
SCHEMBL29668691 0.79 HTR3E (0.56) HTR2CGSK3BHTR2AHTR2BPIM1
SCHEMBL3272320 0.79 HTR2C (0.56) HTR2CGSK3BHTR2AHTR2BLATS1
SCHEMBL3266317 0.79 HTR2C (0.56) HTR2CGSK3BHTR2AHTR2BLATS1
SCHEMBL17884819 0.78 HTR2C (0.47) HTR2CMMP2ADAMTS5GSK3BHTR2A
SCHEMBL30609652 0.78 HTR2C (0.47) HTR2CMMP2ADAMTS5GSK3BHTR2A
SCHEMBL17884822 0.77 MMP2 (0.42) HTR2CMMP2ADAMTS5GSK3BHTR2A

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11718588-B2 5-[(piperazin-1-yl)-3-oxo-propyl]-imidazolidine-2,4-dione derivatives as ADAMTS inhibitors for the treatment of osteoarthritis GALAPAGOS NV (BE) 2023-08-08 US 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 (1 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-11718588-B2 5-[(piperazin-1-yl)-3-oxo-propyl]-imidazolidine-2,4-dione derivatives as ADAMTS inhibitors for the treatment of osteoarthritis ADAMTS1, ADAMTS5, ADAMTS7 HTR2C 2380/4885MMP2 53/4885ADAMTS5 2/4885

“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.