SCHEMBL8735604

SCHEMBL8735604

O=S(=O)(O)c1[c]c2cc(O)ccc2cc1.[NaH]

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.36
CA2 P00918 6/20 0.33
HSD17B10 Q99714 3/20 0.33
HPGD P15428 2/20 0.33
HIF1A Q16665 2/20 0.33
CYP1A2 P05177 1/20 0.32
MPL P40238 2/20 0.32
ESR1 P03372 2/20 0.31
ESR2 Q92731 2/20 0.31
MAOA P21397 1/20 0.31
UGT1A1 P22309 1/20 0.31
MAOB P27338 1/20 0.31
TDP1 Q9NUW8 2/20 0.31
CA12 O43570 2/20 0.31
MCL1 Q07820 2/20 0.31
CA9 Q16790 2/20 0.31
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
ALDH1A1 P00352 1/20 0.31
CA1 P00915 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
SCHEMBL29093382 0.82 ALDH1A1 (0.41) LMNACA2HSD17B10HPGDCYP1A2
SCHEMBL6630329 0.80 ALDH1A1 (0.42) LMNACA2HSD17B10HPGDCYP1A2
SCHEMBL483064 0.76 SMN1; SMN2 (0.37) LMNAMPLTDP1KDM4EALDH1A1
SCHEMBL17707249 0.75 SNCA (0.36) LMNACA2HSD17B10HIF1ACYP1A2
SCHEMBL852203 0.74 ALDH1A1 (0.44) LMNACA2HSD17B10HPGDHIF1A
SCHEMBL1713483 0.71 ALDH1A1 (0.45) LMNACA2HSD17B10HPGDHIF1A
SCHEMBL4285482 0.70 CYP1A2 (0.41) HSD17B10HPGDHIF1ACYP1A2ESR1
SCHEMBL8816822 0.68
SCHEMBL8816827 0.68
Sulfuric Acid SCHEMBL9324873 0.67 CYP1A2 (0.59) LMNACA2HSD17B10HPGDHIF1A

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-0874826-A1 NAPHTHALENE QUINOLINES HAVING LEUKOTRIENE-ANTAGONISTIC ACTION LABORATORIOS MENARINI S.A. (ES) 1998-11-04 EP disclosed
WO-1997024331-A1 NAPHTHALENE QUINOLINES HAVING LEUKOTRIENE-ANTAGONISTIC ACTION LABORATORIOS MENARINI S.A. (ES) 1997-07-10 WO disclosed