SCHEMBL5324600

SCHEMBL5324600

C1=COC2(CC1)CCCCO2

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL11382364 0.84
SCHEMBL6668394 0.76
SCHEMBL17104753 0.73
SCHEMBL1720520 0.72 POLB (0.32)
SCHEMBL3624815 0.70 POLB (0.31)
SCHEMBL19293544 0.70 GAA (0.31)
SCHEMBL10796699 0.70 GAA (0.31)
SCHEMBL16161480 0.70 GAA (0.31)
SCHEMBL8909769 0.70 GAA (0.31)
SCHEMBL13385702 0.70

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007004226-A2 COMPOSITIONS AND METHODS FOR TREATMENT OF MALE ERECTILE DYSFUNCTION (ED) DARLEY PHARMACUETICALS LTD. (IL) 2007-01-11 WO claimed
US-20050272808-A1 Compositions and methods for the treatment of hypertension DARLEY PHARMACEUTICALS (IL) 2005-12-08 US claimed
WO-2007004226-A2 COMPOSITIONS AND METHODS FOR TREATMENT OF MALE ERECTILE DYSFUNCTION (ED) DARLEY PHARMACUETICALS LTD. (IL) 2007-01-11 WO disclosed
US-20050272808-A1 Compositions and methods for the treatment of hypertension DARLEY PHARMACEUTICALS (IL) 2005-12-08 US disclosed