SCHEMBL22892324

SCHEMBL22892324

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

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ CCR1 P32246 8/20 0.50
▸ ALK Q9UM73 1/20 0.48
▸ ADAMTS5 Q9UNA0 6/20 0.48
▸ KMT2A Q03164 2/20 0.48
▸ GAA P10253 1/20 0.48
▸ MAPT P10636 1/20 0.48
▸ SMN1; SMN2 Q16637 1/20 0.48
▸ RAB9A P51151 1/20 0.48
▸ MEN1 O00255 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
SCHEMBL22892267 0.91 KMT2A (0.53) CCR1ALKADAMTS5KMT2AGAA
SCHEMBL22892381 0.87 ADAMTS5 (0.61) CCR1ALKADAMTS5KMT2ARAB9A
SCHEMBL22892312 0.87 ADAMTS5 (0.57) CCR1ALKADAMTS5KMT2AGAA
SCHEMBL22892278 0.85 ADAMTS5 (0.53) CCR1ALKADAMTS5KMT2AMEN1
SCHEMBL22892242 0.85 CCR1 (0.62) CCR1ALKADAMTS5KMT2AGAA
SCHEMBL12765632 0.82 CCR1 (0.65) CCR1ALKRAB9A
SCHEMBL19002660 0.81 KMT2A (0.53) KMT2AGAAMAPTSMN1; SMN2MEN1
SCHEMBL22892271 0.81 CCR1 (0.53) CCR1ALKADAMTS5KMT2AMEN1
SCHEMBL22892289 0.80 ALK (0.48) CCR1ALKADAMTS5KMT2ASMN1; SMN2
SCHEMBL22892237 0.80 KMT2A (0.53) CCR1ALKKMT2AGAAMAPT

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
Send feedback