SCHEMBL6946231

SCHEMBL6946231

CSc1cccc(C(=O)O)c1Oc1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.46
KMT2A Q03164 6/20 0.45
CA12 O43570 1/20 0.45
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
CA4 P22748 1/20 0.45
CA7 P43166 1/20 0.45
CA9 Q16790 1/20 0.45
GAA P10253 1/20 0.44
MEN1 O00255 2/20 0.43
HPGD P15428 4/20 0.42
ALDH1A1 P00352 3/20 0.41
HSD17B10 Q99714 2/20 0.41
MAPK1 P28482 2/20 0.41
KDM4E B2RXH2 1/20 0.41
AKR1C3 P42330 1/20 0.41
ALOX15 P16050 1/20 0.41
CTNNB1 P35222 1/20 0.40
GFER P55789 1/20 0.40
APEX1 P27695 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
SCHEMBL8031428 0.82 ALDH1A1 (0.54) CA12CA1CA2CA4CA7
SCHEMBL6151978 0.78 ALDH1A1 (0.62) POLBKMT2AGAAMEN1HPGD
SCHEMBL709788 0.77 POLB (0.68) POLBKMT2ACA12CA1CA2
SCHEMBL29391544 0.77 POLB (0.68) POLBKMT2ACA12CA1CA2
SCHEMBL1270521 0.76 ALDH1A1 (0.55) CA12CA1CA2CA4CA7
SCHEMBL1401811 0.76 CTNNB1 (0.58) POLBKMT2AGAAMEN1HPGD
SCHEMBL8954755 0.75 CLCN2 (0.50) HPGDALDH1A1HSD17B10MAPK1KDM4E
Ammonia Solution, Strong SCHEMBL28040603 0.75 POLB (0.65) POLBKMT2ACA12CA1CA2
Hydrochloric Acid SCHEMBL6682455 0.75 POLB (0.65) POLBKMT2ACA12CA1CA2
SCHEMBL28409820 0.75 POLB (0.65) POLBKMT2ACA12CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1268396-A1 DIPHENYL ETHER COMPOUNDS USEFUL IN THERAPY Pfizer Limited (GB) 2003-01-02 EP disclosed
WO-2001072687-A1 DIPHENYL ETHER COMPOUNDS USEFUL IN THERAPY PFIZER LIMITED (GB) 2001-10-04 WO disclosed