SCHEMBL6778457

SCHEMBL6778457

CC(=O)C1=C(O)C(=O)NC1c1ccc(F)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 3/20 0.47
▸ GAA P10253 2/20 0.46
▸ USP2 O75604 1/20 0.44
▸ RXFP1 Q9HBX9 3/20 0.44
▸ KDM4E B2RXH2 4/20 0.43
▸ ALDH1A1 P00352 3/20 0.43
▸ TP53 P04637 1/20 0.43
▸ MAPT P10636 1/20 0.43
▸ HPGD P15428 1/20 0.43
▸ HTT P42858 2/20 0.43
▸ ALOX15 P16050 1/20 0.43
▸ CA12 O43570 1/20 0.42
▸ CA1 P00915 1/20 0.42
▸ CA2 P00918 1/20 0.42
▸ CA7 P43166 1/20 0.42
▸ CA9 Q16790 1/20 0.42
▸ MEN1 O00255 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ LMNA P02545 1/20 0.40
▸ ALOX12 P18054 1/20 0.40

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
SCHEMBL6778453 1.00 TDP1 (0.47) TDP1GAAUSP2RXFP1KDM4E
SCHEMBL15196535 0.78 USP2 (0.73) TDP1GAAUSP2RXFP1KDM4E
SCHEMBL22900275 0.71 CCR1 (0.45) GAAUSP2RXFP1KDM4EALDH1A1
SCHEMBL29009203 0.70 MEN1 (0.43) TDP1GAARXFP1KDM4EALDH1A1
SCHEMBL19732957 0.69 GAA (0.67) TDP1GAAUSP2RXFP1KDM4E
SCHEMBL19732950 0.69 GAA (0.67) TDP1GAAUSP2RXFP1KDM4E
SCHEMBL19732951 0.69 GAA (0.67) TDP1GAAUSP2RXFP1KDM4E
SCHEMBL29009154 0.67 GAA (0.42) TDP1GAARXFP1KDM4EALDH1A1
SCHEMBL10153183 0.66 GAA (0.56) TDP1GAAUSP2RXFP1MAPT
SCHEMBL14413503 0.66 GAA (0.64) TDP1GAAUSP2RXFP1KDM4E

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-6727275-B2 ANTIINFLAMMATORY, ANTIALLERGEN, AND ANTIASTHMATIC AGENTS UCB, S.A./N.V. (BE) 2004-04-27 — — US claimed
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