SCHEMBL10668458

SCHEMBL10668458

Cc1ccccc1N(C(=O)CN1Cc2c(cccc2OCCCC(=O)N(C)Cc2ccccc2)N=C1N)N(C)C

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PDE3B Q13370 2/20 0.41
PDE3A Q14432 2/20 0.41
PDE4A P27815 13/20 0.37
PDE4B Q07343 13/20 0.37
PDE4C Q08493 13/20 0.37
PDE4D Q08499 13/20 0.37
ACKR3 P25106 1/20 0.36
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
KMT2A Q03164 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
SCHEMBL10668460 0.87 PDE3B (0.41) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL10648123 0.85 KMT2A (0.39) PDE3BPDE3ANPC1RAB9AKMT2A
SCHEMBL10665307 0.85 PDE4A (0.40) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7313141 0.83 PDE3B (0.37) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7313605 0.80 PDE4A (0.40) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7321069 0.80 PDE4A (0.43) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7311174 0.77 PDE4A (0.40) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7313145 0.77 PDE4A (0.43) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL10649421 0.74 PDE3B (0.40) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL10649789 0.72 NPC1 (0.38) PDE3BPDE3APDE4APDE4BPDE4C

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-4761416-A ENZYME INHIBITORS, INOTROPIC AGENTS SYNTEX (U.S.A.) INC. (US) 1988-08-02 US disclosed