SCHEMBL10761737

SCHEMBL10761737

CC1CC(=O)NN=C1C=Cc1ccc(Br)cc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDE3B Q13370 12/20 0.67
▸ PDE3A Q14432 12/20 0.67
▸ PBRM1 Q86U86 1/20 0.40
▸ RAB9A P51151 4/20 0.39
▸ LMNA P02545 3/20 0.39
▸ SMN1; SMN2 Q16637 3/20 0.39
▸ KDM4E B2RXH2 2/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ PDE4A P27815 1/20 0.37
▸ PDE4B Q07343 1/20 0.37
▸ PDE4C Q08493 1/20 0.37
▸ PDE4D Q08499 1/20 0.37
▸ NPC1 O15118 1/20 0.36
▸ POLB P06746 1/20 0.36
▸ GAA P10253 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ PKM P14618 1/20 0.36
▸ CYP3A4 P08684 1/20 0.36
▸ CYP2D6 P10635 1/20 0.36
▸ CYP2C9 P11712 1/20 0.36

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
SCHEMBL10761216 0.87 PDE3B (0.65) PDE3BPDE3APBRM1RAB9ALMNA
SCHEMBL10761194 0.87 PDE3B (0.65) PDE3BPDE3APBRM1RAB9ALMNA
SCHEMBL10759796 0.87 PDE3B (0.69) PDE3BPDE3APBRM1RAB9ALMNA
SCHEMBL10765163 0.87 PDE3B (0.65) PDE3BPDE3APBRM1RAB9ALMNA
SCHEMBL7285568 0.87 PDE3B (0.65) PDE3BPDE3APBRM1RAB9ALMNA
SCHEMBL10760728 0.85 PDE3B (0.73) PDE3BPDE3APBRM1RAB9ALMNA
SCHEMBL10767384 0.85 PDE3B (0.62) PDE3BPDE3ARAB9ALMNASMN1; SMN2
SCHEMBL10761240 0.85 PDE3B (0.62) PDE3BPDE3APBRM1RAB9ALMNA
SCHEMBL10760276 0.83 PDE3B (0.61) PDE3BPDE3APBRM1RAB9ALMNA
SCHEMBL10764405 0.83 PDE3A (0.61) PDE3BPDE3APBRM1PDE4BCYP3A4

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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