SCHEMBL9639016

SCHEMBL9639016

Cc1cc(C(=O)c2cc(O)c(O)c(O)c2)c(O)c(O)c1O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 1/20 0.56
BCL2 P10415 2/20 0.44
MCL1 Q07820 2/20 0.44
KDM4E B2RXH2 3/20 0.43
LMNA P02545 3/20 0.43
TDP1 Q9NUW8 3/20 0.43
FUT7 Q11130 2/20 0.43
ALDH1A1 P00352 2/20 0.43
MAPT P10636 2/20 0.43
SELL P14151 2/20 0.43
SELP P16109 2/20 0.43
CA12 O43570 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
TP53 P04637 1/20 0.43
CA3 P07451 1/20 0.43
HPGD P15428 1/20 0.43
FUT4 P22083 1/20 0.43
CA4 P22748 1/20 0.43
CA6 P23280 1/20 0.43

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
SCHEMBL9639958 0.85 FASN (0.45) HDAC1BCL2MCL1KDM4ELMNA
SCHEMBL6842046 0.84 BCL2 (0.54) HDAC1BCL2MCL1KDM4ELMNA
SCHEMBL9639982 0.84 SIRT1 (0.47) HDAC1BCL2MCL1KDM4EALDH1A1
SCHEMBL9638961 0.84 HDAC1 (0.70) HDAC1BCL2MCL1KDM4ELMNA
SCHEMBL26441471 0.83 HDAC1 (0.70) HDAC1BCL2MCL1KDM4ELMNA
SCHEMBL26441843 0.82 HDAC1 (0.46) HDAC1BCL2MCL1KDM4ELMNA
SCHEMBL9639963 0.81 HDAC1 (0.56) HDAC1BCL2MCL1KDM4ELMNA
SCHEMBL8680650 0.79 BCL2 (0.68) BCL2MCL1KDM4ELMNATDP1
SCHEMBL19003431 0.78 HDAC1 (0.58) HDAC1BCL2MCL1KDM4ELMNA
SCHEMBL9640337 0.77 HDAC1 (0.56) HDAC1BCL2MCL1KDM4ELMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0227487-B1 POSITIVE TYPE RADIATION-SENSITIVE RESIN COMPOSITION JAPAN SYNTHETIC RUBBER CO., LTD. (JP) 1992-07-15 EP disclosed
US-5087548-A POSITIVE TYPE RADIATION-SENSITIVE RESIN COMPOSITION JAPAN SYNTHETIC RUBBER CO., INC. (JP) 1992-02-11 US disclosed
EP-0227487-A2 Positive type radiation-sensitive resin composition JAPAN SYNTHETIC RUBBER CO., LTD. (JP) 1987-07-01 EP disclosed