SCHEMBL10716827

SCHEMBL10716827

C=Cc1ccc(COC(=O)c2ccc(O)c(O)c2)cc1

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.53
KMT2A Q03164 1/20 0.53
CA12 O43570 3/20 0.53
CA1 P00915 3/20 0.53
CA2 P00918 3/20 0.53
CA7 P43166 3/20 0.53
CA9 Q16790 3/20 0.53
CA14 Q9ULX7 3/20 0.53
PTPN1 P18031 2/20 0.49
ESR1 P03372 1/20 0.47
ESR2 Q92731 1/20 0.47
AKR1B10 O60218 1/20 0.46
TTR P02766 1/20 0.46
AKR1B1 P15121 1/20 0.46
LMNA P02545 1/20 0.45
XDH P47989 2/20 0.45
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
SNCA P37840 1/20 0.42

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
SCHEMBL10716837 0.87 TYR (0.55) MEN1KMT2AESR1
SCHEMBL14458602 0.85 KMT2A (0.74) MEN1KMT2ACA12CA1CA2
SCHEMBL8425259 0.83 KMT2A (0.49) MEN1KMT2ALMNANPC1RAB9A
SCHEMBL9750441 0.81 CA12 (0.66) MEN1KMT2ACA12CA1CA2
SCHEMBL9749965 0.81 KMT2A (0.57) MEN1KMT2ACA12CA1CA2
SCHEMBL30935750 0.81 NPC1 (0.49) MEN1KMT2ALMNANPC1RAB9A
SCHEMBL26497867 0.81 NPC1 (0.49) MEN1KMT2ALMNANPC1RAB9A
SCHEMBL537056 0.80 LMNA (0.70) MEN1KMT2ACA12CA1CA2
SCHEMBL10747911 0.80 CA12 (0.55) MEN1KMT2ACA12CA1CA2
SCHEMBL14586697 0.79 KMT2A (0.56) MEN1KMT2ALMNANPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-62099190-A None JP disclosed
JP-62117789-A None JP disclosed
JP-S62117789-A THERMAL RECORDING MATERIAL RICOH CO LTD 1987-05-29 JP disclosed
JP-S6299190-A THERMAL RECORDING MATERIAL RICOH CO LTD 1987-05-08 JP disclosed