SCHEMBL8015706

SCHEMBL8015706

Bc1cc(C=O)cc(C(=O)O)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
UNG P13051 1/20 0.52
ALDH1A1 P00352 2/20 0.48
TRIM24 O15164 1/20 0.41
TRIM33 Q9UPN9 1/20 0.41
CA12 O43570 2/20 0.38
CA1 P00915 2/20 0.38
CA2 P00918 2/20 0.38
CA7 P43166 2/20 0.38
CA9 Q16790 2/20 0.38
CA14 Q9ULX7 2/20 0.38
TPMT P51580 3/20 0.37
KDM4E B2RXH2 2/20 0.37
TP53 P04637 2/20 0.37
LMNA P02545 1/20 0.37
CA3 P07451 1/20 0.37
MAPT P10636 1/20 0.37
SELL P14151 1/20 0.37
HPGD P15428 1/20 0.37
SELP P16109 1/20 0.37
FUT4 P22083 1/20 0.37

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
SCHEMBL16434649 0.84 UNG (0.61) UNGALDH1A1TRIM24TRIM33CA12
SCHEMBL3470017 0.84 UNG (0.61) UNGALDH1A1TRIM24TRIM33CA12
SCHEMBL10447787 0.79 CA12 (0.50) ALDH1A1CA12CA1CA2CA7
SCHEMBL13761236 0.79 CA12 (0.50) ALDH1A1CA12CA1CA2CA7
SCHEMBL17049785 0.78 UNG (0.55) UNGALDH1A1TRIM24TRIM33CA12
SCHEMBL17049781 0.78 UNG (0.55) UNGALDH1A1TRIM24TRIM33CA12
SCHEMBL8006017 0.77 ALDH1A1 (0.55) ALDH1A1CA12CA1CA2CA7
SCHEMBL17167118 0.77 UNG (0.53) UNGALDH1A1TRIM24TRIM33CA12
SCHEMBL18267471 0.77 CA12 (0.62) UNGALDH1A1TRIM24TRIM33CA12
SCHEMBL15715521 0.77 ALDH1A1 (0.36) UNGALDH1A1KDM4EHSD17B10TDP1

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-2009110985-A2 AMIDE COMPOUNDS, COMPOSITIONS AND USES THEREOF RENOVIS, INC. (US) 2009-09-11 WO disclosed