SCHEMBL10412146

SCHEMBL10412146

O=C(Nc1ccc(CCc2ccc(O)cc2O)cc1)C1=C(O)c2ccccc2SC1

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ ALOX15 P16050 7/20 0.44
▸ MAPT P10636 3/20 0.40
▸ TP53 P04637 1/20 0.40
▸ ALDH1A1 P00352 2/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ CYP3A4 P08684 1/20 0.39
▸ TSHR P16473 1/20 0.39
▸ MAPKAPK2 P49137 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ PTGES O14684 1/20 0.38
▸ TYR P14679 2/20 0.38
▸ ESRRG P62508 1/20 0.36
▸ ADRB2 P07550 1/20 0.36

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
SCHEMBL10412488 0.87 MAPT (0.42) ALOX15MAPTTP53SMN1; SMN2PTGES
SCHEMBL10412130 0.86 ALOX15 (0.56) ALOX15MAPTTP53PTGES
SCHEMBL10411293 0.85 PTGES (0.42) ALOX15MAPTTP53MEN1KMT2A
SCHEMBL10412040 0.84 MAPT (0.45) ALOX15MAPTTP53ALDH1A1MEN1
SCHEMBL10411370 0.83 ALOX15 (0.45) ALOX15MAPTTP53MEN1KMT2A
SCHEMBL10413084 0.83 MAPT (0.39) ALOX15MAPTTP53ALDH1A1MEN1
SCHEMBL10412940 0.82 POLB (0.45) MAPTTP53ALDH1A1MEN1TSHR
SCHEMBL10411296 0.81 ALOX15 (0.57) ALOX15
SCHEMBL10411974 0.81 MAPT (0.43) ALOX15MAPTTP53
SCHEMBL10411350 0.81 MAPT (0.39) ALOX15MAPTTP53PTGES

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4921871-A LIPOXYGENASE INHIBITORS WARNER-LAMBERT COMPANY (US) 1990-05-01 — — US claimed
US-4921871-A LIPOXYGENASE INHIBITORS WARNER-LAMBERT COMPANY (US) 1990-05-01 — — US disclosed
US-4874758-A LIPOXYGENASE INHIBITORS WARNER-LAMBERT COMPANY (US) 1989-10-17 — — US disclosed
US-4868195-A ENZYME INHIBITORS, ANTIALLERGEN, ASTHMA, CARDIOVASCULAR, ANTIINFLAMMATORY WARNER-LAMBERT COMPANY (US) 1989-09-19 — — US disclosed
US-4868205-A ANTIALLERGENS, ANTIINFLAMMATORY, CARDIOVASCULAR DISORDERS WARNER-LAMBERT COMPANY (US) 1989-09-19 — — US disclosed
US-4868200-A LEUKOTRIENES, LIPOXYGENASE INHIBITORS WARNER-LAMBERT COMPANY (US) 1989-09-19 — — US disclosed
US-4868199-A ENZYME INHIBITORS, ANTIALLERGEN, ASTHMA, CARDIOVASCULAR, ANTIINFLAMMATORY WARNER-LAMBERT COMPANY (US) 1989-09-19 — — US disclosed
US-4761424-A Enolamides, pharmaceutical compositions and methods for treating inflammation WARNER-LAMBERT COMPANY (US) 1988-08-02 — — US disclosed
EP-0221345-A1 Novel enolamides, process for their manufacture and pharmaceutical compositions thereof with an activity as modulators of the arachidonic acid cascade WARNER-LAMBERT COMPANY (US) 1987-05-13 — — EP disclosed
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