SCHEMBL9826824

SCHEMBL9826824

COc1ccc(C(=O)Nc2ccc(CCc3ccc(O)c(O)c3)cc2)c(O)c1

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALOX15 P16050 10/20 0.75
▸ KLKB1 P03952 2/20 0.72
▸ PNLIP P16233 2/20 0.55
▸ CCR5 P51681 1/20 0.53
▸ IGF1R P08069 1/20 0.53
▸ MEN1 O00255 1/20 0.53
▸ NPC1 O15118 1/20 0.53
▸ CASP3 P42574 1/20 0.53
▸ RAB9A P51151 1/20 0.53
▸ KMT2A Q03164 1/20 0.53
▸ SENP7 Q9BQF6 1/20 0.53
▸ SENP6 Q9GZR1 1/20 0.53
▸ PLG P00747 2/20 0.53
▸ KLK1 P06870 2/20 0.53
▸ KLK6 Q92876 2/20 0.53
▸ AKR1B1 P15121 1/20 0.51
▸ F2 P00734 1/20 0.51
▸ F10 P00742 1/20 0.51
▸ PLAU P00749 1/20 0.51
▸ PLAT P00750 1/20 0.51

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
SCHEMBL14289118 0.85 KLKB1 (0.72) ALOX15KLKB1PNLIPCCR5MEN1
SCHEMBL9827322 0.85 ALOX15 (0.61) ALOX15KLKB1PNLIPMEN1NPC1
SCHEMBL9826365 0.84 ALOX15 (1.00) ALOX15KLKB1CCR5NPC1RAB9A
SCHEMBL9827298 0.83 KLKB1 (0.62) ALOX15KLKB1PNLIPCCR5MEN1
SCHEMBL10384347 0.81 ALOX15 (1.00) ALOX15KLKB1PNLIPPLGF2
SCHEMBL23849525 0.79 NPC1 (0.58) ALOX15IGF1RMEN1NPC1RAB9A
SCHEMBL9826900 0.79 ALOX15 (1.00) ALOX15CCR5MEN1NPC1RAB9A
SCHEMBL2272830 0.79 KLKB1 (0.69) ALOX15KLKB1PNLIPMEN1NPC1
SCHEMBL14289085 0.78 PLAU (0.60) ALOX15KLKB1PNLIPCCR5MEN1
SCHEMBL27793852 0.77 IGF1R (0.86) ALOX15IGF1RRAB9AAKR1B1

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0221346-B1 (N-SUBSTITUTED-2-HYDROXY) BENZAMIDES AND N-SUBSTITUTED-2-HYDROXY-ALPHA-OXO-BENZENEACETAMIDES AND PHARMACEUTICAL COMPOSITIONS THEREOF HAVING ACTIVITY AS MODULATORS OF THE ARACHIDONIC ACID CASCADE WARNER-LAMBERT COMPANY (US) 1991-01-30 — — EP claimed
EP-0221346-A1 (N-substituted-2-hydroxy) benzamides and N-substituted-2-hydroxy-alpha-oxo-benzeneacetamides and pharmaceutical compositions thereof having activity as modulators of the arachidonic acid cascade WARNER-LAMBERT COMPANY (US) 1987-05-13 — — EP claimed
EP-0221346-B1 (N-SUBSTITUTED-2-HYDROXY) BENZAMIDES AND N-SUBSTITUTED-2-HYDROXY-ALPHA-OXO-BENZENEACETAMIDES AND PHARMACEUTICAL COMPOSITIONS THEREOF HAVING ACTIVITY AS MODULATORS OF THE ARACHIDONIC ACID CASCADE WARNER-LAMBERT COMPANY (US) 1991-01-30 — — EP disclosed
US-4939133-A N-substituted-2-hydroxy-α-oxo-benzeneacetamides and pharmaceutical compositions having activity as modulators of the arachidonic acid cascade WARNER-LAMBERT COMPANY (US) 1990-07-03 — — US disclosed
EP-0221346-A1 (N-substituted-2-hydroxy) benzamides and N-substituted-2-hydroxy-alpha-oxo-benzeneacetamides and pharmaceutical compositions thereof having activity as modulators of the arachidonic acid cascade WARNER-LAMBERT COMPANY (US) 1987-05-13 — — EP disclosed
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