SCHEMBL6841440

SCHEMBL6841440

CSc1ccc(C(=O)c2ccc(O)c(O)c2)cc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIRT1 Q96EB6 1/20 0.59
MCL1 Q07820 1/20 0.49
CA12 O43570 4/20 0.48
CA1 P00915 4/20 0.48
CA2 P00918 4/20 0.48
CA7 P43166 4/20 0.48
CA9 Q16790 4/20 0.48
CA14 Q9ULX7 4/20 0.48
KDM4E B2RXH2 2/20 0.48
GAA P10253 2/20 0.48
POLB P06746 1/20 0.48
MAPT P10636 1/20 0.48
CA4 P22748 1/20 0.48
CA6 P23280 1/20 0.48
PTGS2 P35354 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
DBH P09172 1/20 0.47
RECQL P46063 1/20 0.47
XDH P47989 1/20 0.47
PLK1 P53350 1/20 0.47

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
SCHEMBL6182687 0.84 PLK1 (0.61) GAAMAPTL3MBTL1PLK1CYP1A2
SCHEMBL1758192 0.82 CA12 (0.68) SIRT1CA12CA1CA2CA7
SCHEMBL15459684 0.81 PLK1 (0.47) SIRT1GAAMAPTL3MBTL1PLK1
SCHEMBL7588971 0.80 LMNA (0.65) CA12CA1CA2CA7CA9
SCHEMBL6839571 0.79 ALDH1A1 (0.67) SIRT1CA12CA1CA2CA7
SCHEMBL5476111 0.78 MAPT (0.68) SIRT1CA12CA1CA2CA7
SCHEMBL31472599 0.78 HAO1 (0.58) GAAMAPTPTGS2PLK1CYP1A2
SCHEMBL8431978 0.76 MCL1 (0.51) MCL1GAAMAPTPLK1CYP1A2
SCHEMBL7810350 0.76 SRD5A2 (0.62) KDM4EMAPTPLK1CYP1A2CYP3A4
SCHEMBL7802223 0.76 CES2 (0.52) PLK1CYP1A2CYP3A4CYP2C9HPGD

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-6759367-B2 COMPRISING THERMOSENSITIVE ELEMENT AND SUPPORT, THE THERMOSENSITIVE ELEMENT CONTAINING A SUBSTANTIALLY LIGHT-INSENSITIVE ORGANIC SILVER SALT, A 3,4-DIHYDROXYBENZENE COMPOUND, A BINDER AGFA-GEVAERT (BE) 2004-07-06 US disclosed