SCHEMBL8664879

SCHEMBL8664879

O=C1CN(CSCC2CCCCC2)C(=O)N1

nearest known ligand 0.35

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
DAO P14920 2/20 0.35
PDE7A Q13946 1/20 0.34
PIK3CA P42336 1/20 0.33
MTOR P42345 1/20 0.33
KDM6B O15054 1/20 0.33
KDM4A O75164 1/20 0.33
KDM4D Q6B0I6 1/20 0.33
KDM3B Q7LBC6 1/20 0.33
HIF1AN Q9NWT6 1/20 0.33
KDM2A Q9Y2K7 1/20 0.33
PDE4A P27815 1/20 0.31
PDE4B Q07343 1/20 0.31
PDE4C Q08493 1/20 0.31
PDE4D Q08499 1/20 0.31
EPHX1 P07099 1/20 0.31
MAOA P21397 1/20 0.30
MAOB P27338 1/20 0.30
GPR84 Q9NQS5 1/20 0.30

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
SCHEMBL7338893 0.75 PIK3CA (0.39) PIK3CAMTOR
SCHEMBL12004346 0.67 CRBN (0.38) PIK3CAMTOR
SCHEMBL7440315 0.65 EPHX1 (0.39) DAOEPHX1
SCHEMBL27475440 0.65 EPHX1 (0.39) DAOEPHX1
SCHEMBL4332381 0.65 EPHX2 (0.48) DAOMAOB
SCHEMBL561442 0.64
SCHEMBL11640405 0.64 PER2 (0.38)
SCHEMBL4007754 0.64 CHRM5 (0.52) EPHX1
SCHEMBL8999579 0.64 CRBN (0.46)
SCHEMBL8658916 0.62 DAO (0.40) DAO

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
US-5767140-A USEFUL FOR TREATING AIDS SOUTHERN RESEARCH INSTITUTE (US) 1998-06-16 US disclosed