SCHEMBL10884707

SCHEMBL10884707

CNc1ccc(C2=NNC(=O)NC2C)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDE3B Q13370 14/20 0.50
▸ PDE3A Q14432 14/20 0.50
▸ PDE4A P27815 2/20 0.50
▸ PDE4B Q07343 2/20 0.50
▸ PDE4C Q08493 2/20 0.50
▸ PDE4D Q08499 2/20 0.50
▸ GPR119 Q8TDV5 1/20 0.45
▸ TNNC1 P63316 1/20 0.38
▸ ALDH1A1 P00352 2/20 0.36
▸ CYP3A4 P08684 2/20 0.36
▸ ALOX15 P16050 2/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ CYP1A2 P05177 1/20 0.36
▸ TSHR P16473 1/20 0.36
▸ MAPK1 P28482 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ BLM P54132 1/20 0.36
▸ NPSR1 Q6W5P4 1/20 0.36
▸ MAPT P10636 1/20 0.34
▸ SMN1; SMN2 Q16637 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
SCHEMBL10854225 0.86 PDE3B (0.49) PDE3BPDE3APDE4APDE4BPDE4C
Hydrochloric Acid SCHEMBL10855844 0.84 PDE3B (0.48) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL10633041 0.83 PDE3B (0.48) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL10850035 0.82 PDE3B (0.49) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL10849393 0.82 PDE3B (0.44) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL10815443 0.80 PDE3B (0.52) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL10809030 0.80 PDE3B (0.58) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL10851310 0.80 PDE3B (0.52) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL9836220 0.80 PDE3B (0.52) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL10887567 0.80 PDE3B (0.44) 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-4616015-A HYPOTENSIVE AGENT, ANTULCER AGENT, ANTICOAGULANT FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1986-10-07 — — US disclosed
EP-0122627-A2 Triazine derivatives, processes for preparation thereof and pharmaceutical compositions comprising the same FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1984-10-24 — — EP disclosed
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