SCHEMBL9533683

SCHEMBL9533683

COc1cc(/C=C/C(=O)CCCCc2ccccc2)ccc1O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 5/20 1.00
▸ APP P05067 4/20 0.70
▸ MAPT P10636 4/20 0.70
▸ TTR P02766 1/20 0.68
▸ CA12 O43570 3/20 0.66
▸ CA4 P22748 3/20 0.66
▸ CA6 P23280 3/20 0.66
▸ CA5A P35218 3/20 0.66
▸ CA7 P43166 3/20 0.66
▸ CA9 Q16790 3/20 0.66
▸ CA14 Q9ULX7 3/20 0.66
▸ CA5B Q9Y2D0 3/20 0.66
▸ NFKB1 P19838 3/20 0.66
▸ KDM4E B2RXH2 3/20 0.66
▸ CYP2D6 P10635 2/20 0.66
▸ CYP2C9 P11712 2/20 0.66
▸ TSHR P16473 2/20 0.66
▸ HSD17B10 Q99714 2/20 0.66
▸ JUN P05412 2/20 0.66
▸ ABCB1 P08183 2/20 0.66

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
SCHEMBL3686080 1.00 ALOX5 (1.00) ALOX5APPMAPTTTRCA12
SCHEMBL30219096 1.00 ALOX5 (1.00) ALOX5APPMAPTTTRCA12
SCHEMBL29489703 0.92 ALOX5 (0.84) ALOX5APPMAPTTTRKDM4E
SCHEMBL18509085 0.91 ALOX5 (0.84) ALOX5APPMAPTTTRCA12
SCHEMBL9695487 0.91 ALOX5 (0.84) ALOX5APPMAPTTTRCA12
SCHEMBL9534542 0.91 ALOX5 (0.83) ALOX5APPMAPTTTRKDM4E
SCHEMBL29489695 0.91 ALOX5 (0.83) ALOX5APPMAPTTTRKDM4E
SCHEMBL9534555 0.91 ALOX5 (0.83) ALOX5APPMAPTTTRKDM4E
Ferulate SCHEMBL19125271 0.90 ALOX5 (0.81) ALOX5APPMAPTTTRCA12
Ferulate SCHEMBL17440479 0.90 ALOX5 (0.81) ALOX5APPMAPTTTRCA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0241043-B1 NOVEL DIARYLALKANOIDS HAVING ACTIVITY AS LIPOXYGENASE INHIBITORS WARNER-LAMBERT COMPANY (US) 1993-09-01 — — EP disclosed
US-5177259-A Diarylalkanoids having activity as lipoxygenase inhibitors WARNER-LAMBERT COMPANY (US) 1993-01-05 — — US disclosed
US-5142095-A Treating inflammation, allergies, asthma, cardiovascular disorders, psoriasis WARNER-LAMBERT COMPANY (US) 1992-08-25 — — US disclosed
US-5077411-A Antiallergens, antiinflammatory agents; cardiovascular disorders, migraines, psoriasis WARNER-LAMBERT CO. (US) 1991-12-31 — — US disclosed
US-4959503-A Diarylalkanoids having activity as lipoxygenase inhibitors WARNER-LAMBERT COMPANY (US) 1990-09-25 — — US disclosed
US-4810716-A ANTIINFLAMMATORY, ANTIALLERGY, ANTIISCHEMIC WARNER-LAMBERT COMPANY (US) 1989-03-07 — — US disclosed
EP-0241043-A2 Novel diarylalkanoids having activity as lipoxygenase inhibitors WARNER-LAMBERT COMPANY (US) 1987-10-14 — — EP disclosed
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