SCHEMBL10852124

SCHEMBL10852124

CC(C)C(=O)Nc1ccc(C2=NNC(=O)NC2C)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDE3B Q13370 3/20 0.47
▸ PDE3A Q14432 3/20 0.47
▸ RAB9A P51151 4/20 0.44
▸ NPC1 O15118 3/20 0.44
▸ POLB P06746 2/20 0.44
▸ ALDH1A1 P00352 5/20 0.44
▸ GAA P10253 1/20 0.44
▸ PDE4A P27815 1/20 0.43
▸ PDE4B Q07343 1/20 0.43
▸ PDE4C Q08493 1/20 0.43
▸ PDE4D Q08499 1/20 0.43
▸ KMT2A Q03164 4/20 0.42
▸ MEN1 O00255 3/20 0.42
▸ MAPT P10636 2/20 0.42
▸ RXFP1 Q9HBX9 1/20 0.42
▸ KDM4E B2RXH2 3/20 0.41
▸ GLA P06280 1/20 0.41
▸ SMN1; SMN2 Q16637 3/20 0.40
▸ HPGD P15428 1/20 0.40
▸ HTT P42858 1/20 0.40

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
SCHEMBL10887686 0.91 PDE3B (0.46) PDE3BPDE3ARAB9ANPC1POLB
SCHEMBL10885868 0.90 PDE3B (0.45) PDE3BPDE3ARAB9ANPC1POLB
SCHEMBL10849673 0.86 PDE3B (0.45) PDE3BPDE3AALDH1A1PDE4APDE4B
SCHEMBL10886403 0.86 PDE3B (0.45) PDE3BPDE3AALDH1A1PDE4APDE4B
SCHEMBL10636413 0.85 PDE3B (0.64) PDE3BPDE3APOLBALDH1A1GAA
SCHEMBL10888365 0.84 PDE3B (0.47) PDE3BPDE3APOLBALDH1A1PDE4A
SCHEMBL10891566 0.83 GPR119 (0.43) PDE3BPDE3APOLBALDH1A1GAA
SCHEMBL10887832 0.83 PDE3B (0.51) PDE3BPDE3AALDH1A1PDE4APDE4B
SCHEMBL10633041 0.83 PDE3B (0.48) PDE3BPDE3APOLBALDH1A1PDE4A
SCHEMBL10846981 0.82 GPR119 (0.47) PDE3BPDE3ARAB9ANPC1PDE4A

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-4618610-A Triazine derivatives, and pharmaceutical compositions comprising the same FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1986-10-21 — — US disclosed
EP-0123254-A1 Triazine derivatives, processes for preparation thereof and pharmaceutical compositions comprising the same FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1984-10-31 — — EP disclosed
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