SCHEMBL19002658

SCHEMBL19002658

CCC(=O)N1CCN(c2cc(OC)cc(OC)c2)CC1

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 6/20 0.57
▸ RECQL P46063 1/20 0.57
▸ GAA P10253 2/20 0.55
▸ DRD3 P35462 1/20 0.55
▸ GFER P55789 2/20 0.52
▸ MAPK1 P28482 1/20 0.52
▸ KMT2A Q03164 3/20 0.51
▸ L3MBTL1 Q9Y468 2/20 0.51
▸ MEN1 O00255 2/20 0.51
▸ TSHR P16473 1/20 0.51
▸ SMN1; SMN2 Q16637 2/20 0.50
▸ ALDH1A1 P00352 1/20 0.50
▸ LMNA P02545 1/20 0.50
▸ MTNR1B P49286 1/20 0.50
▸ ADRB1 P08588 1/20 0.50

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
SCHEMBL12182367 0.88 L3MBTL1 (0.68) MAPTGAADRD3GFERMAPK1
SCHEMBL14224740 0.87 LMNA (0.63) MAPTRECQLGAAMAPK1KMT2A
SCHEMBL8327503 0.82 L3MBTL1 (0.61) MAPTGAADRD3GFERMAPK1
SCHEMBL19049598 0.82 GFER (0.56) MAPTGAADRD3GFERMAPK1
SCHEMBL5394353 0.82 L3MBTL1 (0.55) MAPTGAAGFERMAPK1KMT2A
SCHEMBL19002660 0.82 KMT2A (0.53) MAPTGAAGFERKMT2AMEN1
SCHEMBL22892278 0.81 ADAMTS5 (0.53) KMT2AMEN1
SCHEMBL22892267 0.81 KMT2A (0.53) MAPTRECQLGAAGFERKMT2A
SCHEMBL3799031 0.79 ME2 (0.64) MAPTGFERMAPK1KMT2AL3MBTL1
SCHEMBL20708381 0.79 TSHR (0.53) GAAMAPK1KMT2AMEN1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3468955-B1 5-[3-[PIPERAZIN-1-YL]-3-OXO-PROPYL]-IMIDAZOLIDINE-2,4-DIONE DERIVATIVES AS ADAMTS 4 AND 5 INHIBITORS FOR TREATING E.G. OSTEOARTHRITIS GALAPAGOS NV (BE) 2021-01-06 — — EP disclosed
US-20170174699-A1 COMPOUNDS FOR THE TREATMENT OF CANCER AND INFLAMMATORY DISEASE SHY Therapeutics LLC 2017-06-22 — — 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-20170174699-A1 COMPOUNDS FOR THE TREATMENT OF CANCER AND INFLAMMATORY DISEASE MAPK6, MAP3K6, MAPK4 MAPT 2731/4885RECQL 3677/4885GAA 2713/4885

“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.

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