SCHEMBL7305735

SCHEMBL7305735

CC(=O)NCCn1nnc2cc(C3=NNC(=O)CC3)ccc21

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDE3B Q13370 9/20 0.42
▸ PDE3A Q14432 9/20 0.42
▸ PDE4A P27815 4/20 0.41
▸ PDE4B Q07343 4/20 0.41
▸ PDE4C Q08493 4/20 0.41
▸ PDE4D Q08499 4/20 0.41
▸ POLB P06746 1/20 0.39
▸ MAPT P10636 3/20 0.38
▸ ALDH1A1 P00352 2/20 0.38
▸ GAA P10253 2/20 0.38
▸ HPGD P15428 2/20 0.38
▸ KDM4E B2RXH2 2/20 0.38
▸ TP53 P04637 2/20 0.38
▸ MEN1 O00255 3/20 0.38
▸ KMT2A Q03164 3/20 0.38
▸ HCAR3 P49019 1/20 0.38
▸ HTT P42858 1/20 0.38
▸ NPSR1 Q6W5P4 1/20 0.38
▸ THRB P10828 1/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.37

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
SCHEMBL7304282 0.83 MAPT (0.41) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7303295 0.82 PDE3B (0.44) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7303692 0.74 MAPT (0.40) MAPTALDH1A1HPGDKDM4EMEN1
SCHEMBL11573498 0.72 SMN1; SMN2 (0.49) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7294591 0.71 PDE3B (0.44) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7303102 0.68 PDE3B (0.43) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL21969542 0.67 PDE3B (0.49) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL21969526 0.66 PDE3B (0.50) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL6559298 0.66 KCNH2 (0.59) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7295569 0.65 PDE3B (0.45) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5135932-A 2-HYDROXYPROPYLAMINO-ALKYL-BENZIMIDAZOLY-5-YL DERIVATIVES AND THEIR USE IN THE TREATMENT OF HEART DISEASE DR. KARL THOMAE GMBH (DE) 1992-08-04 — — US disclosed
EP-0400519-A1 2-Hydroxy-n-propylamines, medicaments containing these compounds and method for preparing them Dr. Karl Thomae GmbH (DE) 1990-12-05 — — EP disclosed
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