SCHEMBL8941742

SCHEMBL8941742

O=C1CCCC1CCc1cccc2ccccc12

nearest known ligand 0.55

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SLC18A2 Q05940 1/20 0.52
SLC6A2 P23975 1/20 0.48
SLC6A4 P31645 1/20 0.48
KCNA5 P22460 2/20 0.44
SCN5A Q14524 2/20 0.44
KDM4E B2RXH2 1/20 0.43
HCRTR1 O43613 1/20 0.41
HCRTR2 O43614 1/20 0.41
MEN1 O00255 1/20 0.41
ALDH1A1 P00352 1/20 0.41
MAPT P10636 1/20 0.41
HPGD P15428 1/20 0.41
KMT2A Q03164 1/20 0.41
BCHE P06276 1/20 0.41
ACP3 P15309 1/20 0.41
SIGMAR1 Q99720 2/20 0.40
DAO P14920 1/20 0.40

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
SCHEMBL12405340 0.96 SLC18A2 (0.51) SLC18A2SLC6A2SLC6A4KCNA5SCN5A
SCHEMBL18253939 0.81 KDM4E (0.56) KDM4EALDH1A1MAPTHPGD
SCHEMBL12405383 0.81 SLC18A2 (0.48) SLC18A2SLC6A2SLC6A4KCNA5SCN5A
SCHEMBL12405393 0.79 SLC18A2 (0.46) SLC18A2SLC6A2SLC6A4KCNA5SCN5A
SCHEMBL12405400 0.75 BCHE (0.48) SLC18A2SLC6A2SLC6A4KCNA5SCN5A
SCHEMBL18440463 0.74 KDM4E (0.53) SLC18A2KDM4E
SCHEMBL12405404 0.74 BCHE (0.47) SLC18A2SLC6A2SLC6A4KCNA5SCN5A
SCHEMBL5830749 0.73 BCHE (0.61) SLC18A2SLC6A2SLC6A4BCHESIGMAR1
SCHEMBL576574 0.72 SLC6A2 (0.57) SLC18A2SLC6A2SLC6A4KCNA5SCN5A
SCHEMBL7882637 0.72 KCNA5 (0.57) SLC18A2SLC6A2SLC6A4KCNA5SCN5A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5480913-A DIHYDRO-PHENANTHRENE DERIVATIVES, SIDE EFFECT REDUCTION ARCH DEVELOPMENT CORPORATION (US) 1996-01-02 US disclosed
EP-0363128-B1 ANTI-ANDROGEN COMPOUNDS ARCH DEVELOPMENT CORPORATION (US) 1993-09-01 EP disclosed
US-5208263-A Dihydrophenanthrene derivatives ARCH DEVELOPMENT CORPORATION (US) 1993-05-04 US disclosed
WO-1990003979-A2 ANTI-ANDROGEN COMPOUNDS ARCH DEVELOPMENT CORPORATION (US) 1990-04-19 WO disclosed
EP-0363128-A2 Anti-androgen compounds ARCH DEVELOPMENT CORPORATION (US) 1990-04-11 EP disclosed