SCHEMBL8805609

SCHEMBL8805609

O=C1CCc2cc(N3CCC(O)CC3)c(Br)cc2N1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HSP90AA1 P07900 1/20 0.37
▸ HSP90AB1 P08238 1/20 0.37
▸ CRBN Q96SW2 3/20 0.36
▸ CA9 Q16790 1/20 0.36
▸ PKM P14618 4/20 0.36
▸ MAPT P10636 2/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ LMNA P02545 2/20 0.35
▸ HTT P42858 2/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ PDE3B Q13370 1/20 0.35
▸ PDE3A Q14432 1/20 0.35
▸ TSHR P16473 2/20 0.35
▸ USP2 O75604 1/20 0.35
▸ CMA1 P23946 1/20 0.34
▸ AHR P35869 1/20 0.34
▸ SMYD3 Q9H7B4 2/20 0.34
▸ CYP19A1 P11511 1/20 0.34

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
SCHEMBL8805728 0.84 LMNA (0.44) CRBNCA9PKMMAPTALDH1A1
SCHEMBL8805822 0.84 LMNA (0.42) CRBNCA9PKMMAPTMEN1
SCHEMBL8808373 0.84 DRD2 (0.39) CRBNCA9PKMMAPTMEN1
SCHEMBL8805021 0.82 CRBN (0.39) CRBNPKMALDH1A1PDE3BPDE3A
SCHEMBL8806081 0.81 DRD2 (0.42) CRBNCA9PKMMAPTMEN1
SCHEMBL8805973 0.81 PDE3B (0.43) MAPTMEN1ALDH1A1KMT2ALMNA
SCHEMBL8806549 0.80 MAPT (0.51) MAPTMEN1ALDH1A1KMT2ALMNA
SCHEMBL8805823 0.79 CRBN (0.44) CRBNPKMMAPTALDH1A1HTT
SCHEMBL8807339 0.76 SLC6A4 (0.52) CRBNPDE3BPDE3ASMYD3
SCHEMBL8806234 0.74 HSP90AA1 (0.37) HSP90AA1HSP90AB1CRBNMAPTMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0583136-B1 Piperidino-3,4-dihydrocarbostyryl compounds for the treatment of ischemic disorders KISSEI PHARMACEUTICAL (JP) 1997-10-08 — — EP disclosed
US-5294718-A Platelet aggregation inhibitors; antiischemic agents; side effect reduction KISSEI PHARMACEUTICAL CO., LTD. (JP) 1994-03-15 — — US disclosed
EP-0583136-A2 Piperidino-3,4-dihydrocarbostyryl compounds for the treatment of ischemic disorders Kissei Pharmaceutical Co., Ltd. (JP) 1994-02-16 — — EP disclosed
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