SCHEMBL10765188

SCHEMBL10765188

C=CCSc1ccc(C=CC2=NNC(=O)CC2C)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDE3B Q13370 11/20 0.56
▸ PDE3A Q14432 11/20 0.56
▸ GAA P10253 3/20 0.34
▸ ALDH1A1 P00352 3/20 0.34
▸ MAPT P10636 2/20 0.34
▸ LMNA P02545 3/20 0.33
▸ RAB9A P51151 3/20 0.33
▸ SMN1; SMN2 Q16637 3/20 0.33
▸ PBRM1 Q86U86 1/20 0.33
▸ NPC1 O15118 1/20 0.33
▸ POLB P06746 1/20 0.33
▸ PKM P14618 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ PDE4A P27815 2/20 0.32
▸ PDE4B Q07343 2/20 0.32
▸ PDE4C Q08493 2/20 0.32
▸ PDE4D Q08499 2/20 0.32
▸ GPR119 Q8TDV5 1/20 0.31
▸ ALOX15 P16050 1/20 0.31

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
SCHEMBL10763903 0.87 PDE3B (0.47) PDE3BPDE3AALDH1A1PBRM1POLB
SCHEMBL10765802 0.83 PDE3B (0.55) PDE3BPDE3AGAAALDH1A1MAPT
SCHEMBL10761240 0.83 PDE3B (0.62) PDE3BPDE3AGAAALDH1A1MAPT
SCHEMBL10764122 0.81 PDE3A (0.46) PDE3BPDE3AGAAALDH1A1MAPT
SCHEMBL10761200 0.81 PDE3A (0.46) PDE3BPDE3AGAAALDH1A1MAPT
SCHEMBL10768068 0.81 PDE3B (0.40) PDE3BPDE3AGAAALDH1A1MAPT
SCHEMBL10763296 0.80 PDE3A (0.43) PDE3BPDE3AGAAALDH1A1PBRM1
SCHEMBL10760541 0.79 PDE3B (0.56) PDE3BPDE3AGAAALDH1A1MAPT
SCHEMBL10761515 0.79 PDE3B (0.38) PDE3BPDE3AGAAALDH1A1MAPT
SCHEMBL10761737 0.79 PDE3B (0.67) PDE3BPDE3AGAAALDH1A1MAPT

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
EP-0210530-A1 6-Arylalkenyl pyridazinones MERCK PATENT GmbH (DE) 1987-02-04 — — EP disclosed
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