SCHEMBL11325784

SCHEMBL11325784

Cc1cc(Cl)cc2c(=O)c(CC(=O)O)c(C(=O)O)oc12

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 6/20 0.39
TTR P02766 1/20 0.38
CSNK2A2 P19784 3/20 0.38
CSNK2B P67870 3/20 0.38
CSNK2A1 P68400 3/20 0.38
AHR P35869 1/20 0.38
CSNK2A3 Q8NEV1 1/20 0.38
KDM4E B2RXH2 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.36
CA12 O43570 1/20 0.35
CA9 Q16790 1/20 0.35
LMNA P02545 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34

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
SCHEMBL11321162 0.86 CSNK2A2 (0.50) MCL1TTRCSNK2A2CSNK2BCSNK2A1
SCHEMBL11325753 0.78 ALDH1A1 (0.41) CSNK2A2CSNK2BCSNK2A1AHRKDM4E
SCHEMBL11324534 0.76 MCL1 (0.57) MCL1TTRKDM4ESMN1; SMN2
SCHEMBL4982792 0.74 SIRT2 (0.47) MCL1TTRCSNK2A2CSNK2BCSNK2A1
SCHEMBL11309294 0.74 POLB (0.35) MCL1CA12CA9
SCHEMBL11313409 0.73 MCL1 (0.57) MCL1TTRKDM4ECA12CA9
SCHEMBL11320518 0.73 TTR (0.52) MCL1TTRL3MBTL1
SCHEMBL6394892 0.71 AKR1B1 (0.47) KDM4ELMNASMN1; SMN2
SCHEMBL11311546 0.70 MAPT (0.49) MCL1KDM4ECA12CA9SMN1; SMN2
SCHEMBL11329000 0.70 MAPT (0.50) MCL1CSNK2A2CSNK2BCSNK2A1KDM4E

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
US-4307020-A REACTING AN 0-HYDROXYACETOPHENONE WITH A GLYOXYLIC ACID BAYER AKTIENGESELLSCHAFT (DE) 1981-12-22 US disclosed
US-4285965-A FUNGICIDES AND INSECTICIDES FOR PLANTS BAYER AKTIENGESELLSCHAFT (DE) 1981-08-25 US disclosed
EP-0000377-B1 PROCESS FOR THE PREPARATION OF CHROMONE DERIVATIVES, NEW CHROMONE DERIVATIVES AND THEIR USE AS PLANT-PROTECTING AGENTS BAYER AG (DE) 1981-01-21 EP disclosed
US-4189498-A FUNGICIDES, ARTHROPODICIDES BAYER AKTIENGESELLSCHAFT (DE) 1980-02-19 US disclosed