SCHEMBL10763206

SCHEMBL10763206

C=CC[S+]([O-])c1ccccc1C=CC1=NNC(=O)CC1C

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ PDE3A Q14432 11/20 0.42
▸ PDE3B Q13370 9/20 0.42
▸ PBRM1 Q86U86 1/20 0.33
▸ PTGS1 P23219 1/20 0.32
▸ PTGS2 P35354 1/20 0.32
▸ GPR119 Q8TDV5 3/20 0.31
▸ SLFN12 Q8IYM2 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ LMNA P02545 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ MAPK1 P28482 1/20 0.31
▸ PDE4B Q07343 3/20 0.30
▸ CREBBP Q92793 3/20 0.30
▸ PDE5A O76074 2/20 0.30
▸ BRD4 O60885 2/20 0.30

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
SCHEMBL10762088 0.85 PDE3A (0.42) PDE3APDE3BPBRM1PTGS1PTGS2
SCHEMBL10764837 0.84 PDE3A (0.46) PDE3APDE3BPBRM1PTGS1PTGS2
SCHEMBL10765377 0.81 PDE3B (0.32) PDE3APDE3BPBRM1GPR119SLFN12
SCHEMBL10761085 0.81 PDE3B (0.54) PDE3APDE3BPBRM1GPR119SLFN12
SCHEMBL10764081 0.81 PDE3B (0.38) PDE3APDE3BPBRM1MAPTCREBBP
SCHEMBL10762928 0.79 PDE3B (0.45) PDE3APDE3BPBRM1PTGS1PTGS2
SCHEMBL10764359 0.78 PDE3A (0.45) PDE3APDE3BGPR119LMNAPDE4B
SCHEMBL10766026 0.78 PDE3A (0.45) PDE3APDE3BGPR119LMNAMAPT
SCHEMBL10765262 0.78 PTGS2 (0.52) PDE3APDE3BPTGS1PTGS2LMNA
SCHEMBL10763296 0.76 PDE3A (0.43) PDE3APDE3BPBRM1PTGS1PTGS2

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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