Veratric Acid

Veratric Acid

SCHEMBL11245872

COc1ccc(C(=O)O)cc1OC.COc1ccc(C(=O)O)cc1OC.OCCO

nearest known ligand 0.85

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 2/20 0.85
CA1 P00915 2/20 0.85
CA2 P00918 2/20 0.85
CA4 P22748 2/20 0.85
CA6 P23280 2/20 0.85
CA7 P43166 2/20 0.85
CA9 Q16790 2/20 0.85
CA14 Q9ULX7 2/20 0.85
TPMT P51580 1/20 0.85
TSHR P16473 4/20 0.70
CYP1A2 P05177 1/20 0.63
CYP3A4 P08684 1/20 0.63
CYP2C9 P11712 1/20 0.63
CYP2C19 P33261 1/20 0.63
NR1H4 Q96RI1 1/20 0.63
TTR P02766 2/20 0.63
HTT P42858 2/20 0.62
MAPK1 P28482 2/20 0.61
LMNA P02545 1/20 0.61
RAB9A P51151 1/20 0.61

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
Veratric Acid SCHEMBL11245191 0.93 CA12 (0.79) CA12CA1CA2CA4CA6
Veratric Acid SCHEMBL29386353 0.92 CA12 (1.00) CA12CA1CA2CA4CA6
Veratric Acid SCHEMBL976032 0.92 CA12 (1.00) CA12CA1CA2CA4CA6
Veratric Acid SCHEMBL114848 0.92 CA12 (1.00) CA12CA1CA2CA4CA6
Veratric Acid SCHEMBL9513127 0.90 CA12 (0.96) CA12CA1CA2CA4CA6
Veratric Acid SCHEMBL3779944 0.90 CA12 (0.96) CA12CA1CA2CA4CA6
Veratric Acid SCHEMBL28597713 0.90 CA12 (0.96) CA12CA1CA2CA4CA6
Veratric Acid SCHEMBL28276206 0.90 CA12 (0.96) CA12CA1CA2CA4CA6
Veratric Acid SCHEMBL5804511 0.90 CA12 (0.96) CA12CA1CA2CA4CA6
SCHEMBL617974 0.86 TSHR (0.71) CA12CA1CA2CA4CA6

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
US-4342875-A STABILIZERS FOR OLEFIN POLYMERS CINCINNATI-MILACRON, INC. (US) 1982-08-03 US claimed