SCHEMBL10412488

SCHEMBL10412488

O=C(Nc1ccc(CCc2cc(O)cc(O)c2)cc1)C1=C(O)c2ccccc2SC1

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 5/20 0.42
▸ TP53 P04637 2/20 0.42
▸ ALOX15 P16050 8/20 0.40
▸ PTGES O14684 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ LTA4H P09960 1/20 0.36
▸ CCR5 P51681 1/20 0.36
▸ NQO2 P16083 1/20 0.35

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
SCHEMBL10412130 0.88 ALOX15 (0.56) MAPTTP53ALOX15PTGESCCR5
SCHEMBL10412146 0.87 ALOX15 (0.44) MAPTTP53ALOX15PTGESSMN1; SMN2
SCHEMBL10411370 0.87 ALOX15 (0.45) MAPTTP53ALOX15PTGES
SCHEMBL10411350 0.86 MAPT (0.39) MAPTTP53ALOX15PTGES
SCHEMBL10412491 0.86 NAMPT (0.41) MAPTTP53SMN1; SMN2
SCHEMBL10413084 0.85 MAPT (0.39) MAPTTP53ALOX15PTGESSMN1; SMN2
SCHEMBL10412040 0.84 MAPT (0.45) MAPTTP53ALOX15PTGESSMN1; SMN2
SCHEMBL10412947 0.83 MAPT (0.50) MAPTTP53PTGESSMN1; SMN2
SCHEMBL10411974 0.83 MAPT (0.43) MAPTTP53ALOX15
SCHEMBL10411293 0.83 PTGES (0.42) MAPTTP53ALOX15PTGES

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 8 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-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-4868195-A ENZYME INHIBITORS, ANTIALLERGEN, ASTHMA, CARDIOVASCULAR, ANTIINFLAMMATORY 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
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