SCHEMBL27627398

SCHEMBL27627398

O=C(O)c1noc(O)c1C(=O)c1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.45
▸ PTPN1 P18031 1/20 0.45
▸ SRD5A2 P31213 1/20 0.44
▸ MAPT P10636 4/20 0.44
▸ KMT2A Q03164 4/20 0.44
▸ MEN1 O00255 3/20 0.44
▸ SMN1; SMN2 Q16637 3/20 0.44
▸ RAB9A P51151 2/20 0.44
▸ NPC1 O15118 1/20 0.44
▸ PKM P14618 1/20 0.44
▸ HPGD P15428 1/20 0.44
▸ CATSPER1 Q8NEC5 1/20 0.42
▸ AKR1C3 P42330 1/20 0.41
▸ LMNA P02545 2/20 0.41
▸ GAA P10253 1/20 0.41
▸ DAO P14920 1/20 0.40
▸ TSHR P16473 1/20 0.40
▸ NAPRT Q6XQN6 1/20 0.40
▸ L3MBTL1 Q9Y468 2/20 0.39
▸ ATM Q13315 1/20 0.39

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
SCHEMBL996654 0.81 ALDH1A1 (0.57) ALDH1A1PTPN1SRD5A2MAPTKMT2A
SCHEMBL8800218 0.79 BRD4 (0.50) ALDH1A1MAPTKMT2AMEN1SMN1; SMN2
SCHEMBL4054650 0.77 PTGS1 (0.44) ALDH1A1PTPN1SRD5A2MAPTKMT2A
SCHEMBL27365043 0.74 CATSPER1 (0.40) ALDH1A1PTPN1SRD5A2MAPTKMT2A
SCHEMBL4054647 0.70 PTPN1 (0.41) ALDH1A1PTPN1SRD5A2MAPTKMT2A
SCHEMBL280055 0.69 PTPN1 (0.54) ALDH1A1PTPN1MAPTKMT2AMEN1
SCHEMBL15891186 0.69 ALDH1A1 (0.56) ALDH1A1SRD5A2MAPTKMT2AMEN1
SCHEMBL8463065 0.68 PTGS2 (0.56) ALDH1A1SRD5A2MAPTKMT2AMEN1
SCHEMBL28533570 0.67 ALDH1A1 (0.68) ALDH1A1SRD5A2MAPTKMT2AMEN1
SCHEMBL28678655 0.67 ALDH1A1 (0.68) ALDH1A1SRD5A2MAPTKMT2AMEN1

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
CN-1976904-A Pyridazin-3 (2H) -one derivatives and their use as PDE4 inhibitors ALMIRALL LAB (ES) 2007-06-06 — — CN disclosed
CN-1668603-A Pyridazin-3(2h)-one derivatives as PDE4 inhibitors ALMIRALL PRODESFARMA SA (ES) 2005-09-14 — — CN disclosed
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