SCHEMBL7313141

SCHEMBL7313141

CNN(C(=O)CN1Cc2c(cccc2OCCCC(=O)N(Cc2ccccc2)Cc2ccccc2)N=C1N)c1ccccc1C

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PDE3B Q13370 2/20 0.37
PDE3A Q14432 2/20 0.37
NPC1 O15118 1/20 0.36
LMNA P02545 1/20 0.36
ALOX15 P16050 1/20 0.36
TSHR P16473 1/20 0.36
MAPK1 P28482 1/20 0.36
HSD17B10 Q99714 1/20 0.36
PDE4A P27815 13/20 0.36
PDE4B Q07343 13/20 0.36
PDE4C Q08493 13/20 0.36
PDE4D Q08499 13/20 0.36
TEAD1 P28347 1/20 0.34
MAPT P10636 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32

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
SCHEMBL7320121 0.88 PDE3B (0.37) PDE3BPDE3ANPC1LMNAALOX15
SCHEMBL7316952 0.86 PDE3B (0.34) PDE3BPDE3ANPC1LMNAALOX15
SCHEMBL7318642 0.85 MAPT (0.34) PDE3BPDE3ANPC1LMNAALOX15
SCHEMBL7308378 0.85 PDE3B (0.39) PDE3BPDE3ANPC1LMNAALOX15
SCHEMBL10668458 0.83 PDE3B (0.41) PDE3BPDE3ANPC1PDE4APDE4B
SCHEMBL7313145 0.82 PDE4A (0.43) PDE3BPDE3ANPC1LMNAALOX15
SCHEMBL7311174 0.81 PDE4A (0.40) PDE3BPDE3ANPC1LMNAALOX15
SCHEMBL10652201 0.80 PDE3B (0.41) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL10668460 0.79 PDE3B (0.41) PDE3BPDE3ANPC1PDE4APDE4B
SCHEMBL7317849 0.78 PDE3B (0.35) PDE3BPDE3ANPC1LMNAALOX15

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 2 patents. 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
US-4739056-A ENZYME INHIBITORS SYNTEX (U.S.A.) INC. (US) 1988-04-19 US disclosed