SCHEMBL6175924

SCHEMBL6175924

COc1ccc(C(=O)c2c(C(=O)O)noc2C)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA1 P00915 1/20 0.50
▸ CA2 P00918 1/20 0.50
▸ ALDH1A1 P00352 3/20 0.48
▸ LMNA P02545 4/20 0.48
▸ SMN1; SMN2 Q16637 3/20 0.48
▸ MAPT P10636 3/20 0.48
▸ HPGD P15428 3/20 0.48
▸ HTT P42858 2/20 0.48
▸ MAPK1 P28482 2/20 0.48
▸ TP53 P04637 2/20 0.48
▸ CYP2C19 P33261 1/20 0.48
▸ PTPN7 P35236 1/20 0.48
▸ HSD17B10 Q99714 1/20 0.48
▸ MEN1 O00255 2/20 0.46
▸ KMT2A Q03164 2/20 0.46
▸ KDM4E B2RXH2 2/20 0.46
▸ ALOX12 P18054 1/20 0.46
▸ RAB9A P51151 2/20 0.45
▸ NPSR1 Q6W5P4 1/20 0.45
▸ RXFP1 Q9HBX9 1/20 0.45

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
SCHEMBL27622437 0.85 ALDH1A1 (0.47) CA1CA2ALDH1A1LMNAMAPT
SCHEMBL27622444 0.84 SRD5A2 (0.52) ALDH1A1LMNASMN1; SMN2MAPTHPGD
SCHEMBL1374393 0.83 ALDH1A1 (0.53) ALDH1A1LMNASMN1; SMN2MAPTHPGD
SCHEMBL996654 0.83 ALDH1A1 (0.57) ALDH1A1LMNASMN1; SMN2MAPTHPGD
SCHEMBL27627423 0.82 LMNA (0.46) ALDH1A1LMNAMAPTHTTMEN1
SCHEMBL27323098 0.81 HIF1A (0.53) ALDH1A1LMNASMN1; SMN2MAPTHPGD
SCHEMBL9429244 0.81 NPC1 (0.56) ALDH1A1LMNASMN1; SMN2MAPTHPGD
SCHEMBL5211761 0.80 LMNA (0.47) ALDH1A1LMNASMN1; SMN2MAPTHPGD
SCHEMBL27641421 0.75 LMNA (0.46) ALDH1A1LMNASMN1; SMN2MAPTHTT
SCHEMBL2777180 0.75 PTGS2 (0.60) ALDH1A1LMNASMN1; SMN2MAPTHPGD

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
EP-1575926-A1 NEW PYRIDAZIN-3(2H)-ONE DERIVATIVES Almirall Prodesfarma, S.A. (ES) 2005-09-21 — — EP disclosed
WO-2004058729-A1 NEW PYRIDAZIN-3(2H)-ONE DERIVATIVES ALMIRALL PRODESFARMA SA (ES) 2004-07-15 — — WO disclosed
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