SCHEMBL10763296

SCHEMBL10763296

C=CCSc1ccccc1C=CC1=NNC(=O)CC1C

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ PDE3A Q14432 7/20 0.43
▸ PDE3B Q13370 6/20 0.43
▸ PBRM1 Q86U86 1/20 0.34
▸ ALDH1A1 P00352 5/20 0.34
▸ TSHR P16473 3/20 0.34
▸ MAPK1 P28482 2/20 0.34
▸ ALOX15 P16050 1/20 0.34
▸ PTGS1 P23219 1/20 0.33
▸ PTGS2 P35354 1/20 0.33
▸ GPR119 Q8TDV5 3/20 0.32
▸ GAA P10253 2/20 0.32
▸ BRD4 O60885 1/20 0.31
▸ CREBBP Q92793 1/20 0.31
▸ PDE5A O76074 1/20 0.31
▸ PDE4B Q07343 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
SCHEMBL10760321 0.83 PDE3A (0.48) PDE3APDE3BPBRM1PTGS1PTGS2
SCHEMBL10762902 0.83 PDE3A (0.43) PDE3APDE3BPBRM1PTGS1PTGS2
SCHEMBL10764068 0.80 PDE3B (0.33) PDE3APDE3BPBRM1ALDH1A1TSHR
SCHEMBL10765188 0.80 PDE3B (0.56) PDE3APDE3BPBRM1ALDH1A1TSHR
SCHEMBL10763903 0.78 PDE3B (0.47) PDE3APDE3BPBRM1ALDH1A1TSHR
SCHEMBL10763419 0.78 PDE3B (0.43) PDE3APDE3BPBRM1ALDH1A1TSHR
SCHEMBL10764122 0.77 PDE3A (0.46) PDE3APDE3BALDH1A1TSHRMAPK1
SCHEMBL10761200 0.77 PDE3A (0.46) PDE3APDE3BALDH1A1TSHRMAPK1
SCHEMBL10765623 0.77 PDE3A (0.43) PDE3APDE3BPBRM1ALDH1A1PTGS1
SCHEMBL10764037 0.77 PTGS2 (0.54) PDE3APDE3BALDH1A1PTGS1PTGS2

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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