SCHEMBL8183157

SCHEMBL8183157

CCOC(=O)C1CCN(c2nc(NCc3ccc(OC)c(Cl)c3)c3cc(C(F)(F)F)sc3n2)CC1

nearest known ligand 0.47

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 15/20 0.47
POLB P06746 1/20 0.44
KDM4E B2RXH2 1/20 0.44
LMNA P02545 1/20 0.44

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
SCHEMBL8169893 0.93 ALDH1A1 (0.47) PDE5APOLBKDM4E
SCHEMBL8171286 0.93 KDM4E (0.48) PDE5AKDM4E
SCHEMBL8187926 0.92 PDE5A (0.52) PDE5A
SCHEMBL8170057 0.91 PDE5A (0.48) PDE5APOLBKDM4ELMNA
SCHEMBL8179227 0.91 PDE5A (0.48) PDE5APOLBKDM4ELMNA
SCHEMBL8183512 0.90 PDE5A (0.47) PDE5APOLBKDM4ELMNA
SCHEMBL7018309 0.90 PDE5A (0.46) PDE5A
SCHEMBL7016530 0.88 PDE5A (0.47) PDE5A
SCHEMBL8186114 0.87 PDE5A (0.48) PDE5APOLBKDM4ELMNA
SCHEMBL8170085 0.87 CTNNB1 (0.48)

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-6130223-A Thienopyrimidine with phosphodiesterase V inhibiting effect MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2000-10-10 US disclosed