SCHEMBL9700022

SCHEMBL9700022

Cc1cccc(O)c1C(=O)OC(C)(C)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 4/20 0.44
CA1 P00915 4/20 0.44
CA2 P00918 4/20 0.44
CA7 P43166 4/20 0.44
CA9 Q16790 4/20 0.44
CA14 Q9ULX7 4/20 0.44
CYP2C19 P33261 1/20 0.41
HIF1A Q16665 1/20 0.41
ALDH1A1 P00352 1/20 0.41
ALOX15 P16050 1/20 0.41
CYP19A1 P11511 1/20 0.40
TRPA1 O75762 2/20 0.39
MAPK1 P28482 1/20 0.39
ATM Q13315 1/20 0.39
ESR1 P03372 2/20 0.38
ESR2 Q92731 2/20 0.38
THRB P10828 1/20 0.38
KMT2A Q03164 2/20 0.38
MEN1 O00255 1/20 0.38
HDAC4 P56524 1/20 0.36

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
SCHEMBL2220768 0.82 CA12 (0.50) CA12CA1CA2CA7CA9
SCHEMBL28346106 0.78 LMNA (0.55) CA12CA1CA2CA7CA9
SCHEMBL28635035 0.74 MAPK1 (0.48) CYP2C19HIF1AALDH1A1ALOX15MAPK1
SCHEMBL27339498 0.73 CA12 (0.55) CA12CA1CA2CA7CA9
SCHEMBL28700661 0.73 ALDH1A1 (0.52) CYP2C19HIF1AALDH1A1ALOX15MAPK1
SCHEMBL9545793 0.73 CA12 (0.80) CA12CA1CA2CA7CA9
SCHEMBL7753553 0.73 CA12 (0.59) CA12CA1CA2CA7CA9
SCHEMBL4734192 0.72 NSD2 (0.54) CA12CA1CA2CA7CA9
Ethane SCHEMBL28276911 0.72 CA12 (0.53) CA12CA1CA2CA7CA9
SCHEMBL29324959 0.71 NPC1 (0.49) CYP2C19HIF1AALDH1A1ALOX15MAPK1

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-5107006-A Photostabilizers developers SANKO KAIHATSU KAGAKU KENKYUSHO (JP) 1992-04-21 US disclosed