SCHEMBL10074238

SCHEMBL10074238

Cc1ccc(/C=C/C(=O)OCc2ccccc2)cc1

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 3/20 0.79
▸ AKR1B10 O60218 6/20 0.78
▸ AKR1B1 P15121 6/20 0.78
▸ CA12 O43570 3/20 0.78
▸ CA7 P43166 3/20 0.78
▸ CA9 Q16790 3/20 0.78
▸ CA14 Q9ULX7 3/20 0.78
▸ CA4 P22748 2/20 0.78
▸ CA6 P23280 2/20 0.78
▸ CA5A P35218 2/20 0.78
▸ CA5B Q9Y2D0 2/20 0.78
▸ TTR P02766 1/20 0.66
▸ MAOB P27338 1/20 0.59
▸ HCAR2 Q8TDS4 1/20 0.59
▸ CA1 P00915 1/20 0.56
▸ CA2 P00918 1/20 0.56
▸ ALDH1A1 P00352 3/20 0.54
▸ MAPT P10636 3/20 0.54
▸ HPGD P15428 2/20 0.54
▸ CYP3A4 P08684 1/20 0.54

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
SCHEMBL14192951 1.00 LMNA (0.79) LMNAAKR1B10AKR1B1CA12CA7
SCHEMBL13552179 0.92 LMNA (0.93) LMNAAKR1B10AKR1B1CA12CA7
Benzyl Cinnamate SCHEMBL901152 0.89 LMNA (1.00) LMNAAKR1B10AKR1B1CA12CA7
Benzyl Cinnamate SCHEMBL1871854 0.89 LMNA (1.00) LMNAAKR1B10AKR1B1CA12CA7
Benzyl Cinnamate SCHEMBL43212 0.89 LMNA (1.00) LMNAAKR1B10AKR1B1CA12CA7
Benzyl Cinnamate SCHEMBL43213 0.89 LMNA (1.00) LMNAAKR1B10AKR1B1CA12CA7
SCHEMBL28388377 0.88 LMNA (0.79) LMNAAKR1B10AKR1B1CA12CA7
SCHEMBL29087463 0.88 CA12 (0.73) LMNAAKR1B10AKR1B1CA12CA7
SCHEMBL4501587 0.88 AKR1B10 (1.00) LMNAAKR1B10AKR1B1CA12CA7
SCHEMBL22071063 0.88 LMNA (0.84) LMNAAKR1B10AKR1B1CA12CA7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2012024419-A2 BRADYKININ RECEPTOR AGONISTS AND USES THEREOF TO TREAT OCULAR HYPERTENSION AND GLAUCOMA ALCON RESEARCH, LTD. (US) 2012-02-23 — — WO disclosed
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