SCHEMBL22892267

SCHEMBL22892267

CCC(=O)N1CCN(c2cc(OC)c(F)c(OC)c2)CC1

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 4/20 0.53
▸ MAPT P10636 3/20 0.53
▸ SMN1; SMN2 Q16637 2/20 0.53
▸ GAA P10253 2/20 0.53
▸ ADAMTS5 Q9UNA0 3/20 0.49
▸ L3MBTL1 Q9Y468 3/20 0.49
▸ RECQL P46063 1/20 0.48
▸ MEN1 O00255 3/20 0.47
▸ ADAMTS4 O75173 2/20 0.47
▸ GFER P55789 1/20 0.46
▸ CCR1 P32246 2/20 0.46
▸ ALDH1A1 P00352 3/20 0.46
▸ ALK Q9UM73 1/20 0.45
▸ TSHR P16473 1/20 0.45
▸ GPR174 Q9BXC1 1/20 0.44

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
SCHEMBL22892312 0.93 ADAMTS5 (0.57) KMT2AMAPTSMN1; SMN2GAAADAMTS5
SCHEMBL22892324 0.91 CCR1 (0.50) KMT2AMAPTSMN1; SMN2GAAADAMTS5
SCHEMBL19002660 0.87 KMT2A (0.53) KMT2AMAPTSMN1; SMN2GAAMEN1
SCHEMBL22892278 0.86 ADAMTS5 (0.53) KMT2AADAMTS5MEN1ADAMTS4CCR1
SCHEMBL22892242 0.85 CCR1 (0.62) KMT2AMAPTSMN1; SMN2GAAADAMTS5
SCHEMBL22892237 0.85 KMT2A (0.53) KMT2AMAPTSMN1; SMN2GAAL3MBTL1
SCHEMBL22892381 0.82 ADAMTS5 (0.61) KMT2AADAMTS5MEN1ADAMTS4CCR1
SCHEMBL4171024 0.82 CCR1 (0.51) KMT2AMAPTSMN1; SMN2GAAL3MBTL1
SCHEMBL22892271 0.81 CCR1 (0.53) KMT2AADAMTS5MEN1ADAMTS4CCR1
SCHEMBL19002658 0.81 MAPT (0.57) KMT2AMAPTSMN1; SMN2GAAL3MBTL1

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
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
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