SCHEMBL7320601

SCHEMBL7320601

NC(=O)C(CCCOc1ccc(Cl)c2c1N=C1NC(=O)C(CO)N1C2)N1CCc2ccccc21

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PDE3B Q13370 5/20 0.35
PDE3A Q14432 5/20 0.35
LMNA P02545 2/20 0.33
TSHR P16473 2/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2D6 P10635 1/20 0.33
BLM P54132 1/20 0.33
HPGD P15428 2/20 0.32
MAPT P10636 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.31
MEN1 O00255 1/20 0.30
NPC1 O15118 1/20 0.30
RAB9A P51151 1/20 0.30
KMT2A Q03164 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
SCHEMBL7320610 0.85 PDE3B (0.34) PDE3BPDE3ALMNATSHRCYP1A2
SCHEMBL7320606 0.81 PDE3B (0.37) PDE3BPDE3ALMNATSHRCYP1A2
SCHEMBL7316989 0.80 MAPT (0.32) PDE3BPDE3ALMNAHPGDMAPT
SCHEMBL7319827 0.79 PDE3B (0.51) PDE3BPDE3A
SCHEMBL7315285 0.76 PDE3B (0.41) PDE3BPDE3ALMNATSHRMAPT
SCHEMBL7308814 0.75 PDE3B (0.52) PDE3BPDE3A
SCHEMBL7313656 0.71 PDE3B (0.40) PDE3BPDE3A
SCHEMBL7319841 0.71 PDE3B (0.48) PDE3BPDE3A
SCHEMBL7312638 0.69 MAPT (0.35) LMNACYP3A4HPGDMAPTNPSR1
SCHEMBL7316945 0.68 ALDH1A1 (0.36) LMNACYP1A2CYP3A4CYP2D6HPGD

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-4670434-A ANTICOAGULANT, INOTROPIC AGENT SYNTEX (U.S.A.) INC. (US) 1987-06-02 US disclosed