SCHEMBL11316792

SCHEMBL11316792

COC(=O)Cc1c(C(=O)OC)oc2ccccc2c1=O

nearest known ligand 0.57

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.57
ALDH1A1 P00352 3/20 0.51
PLK1 P53350 1/20 0.47
SMN1; SMN2 Q16637 2/20 0.46
NPC1 O15118 3/20 0.46
RAB9A P51151 3/20 0.46
KMT2A Q03164 3/20 0.46
LMNA P02545 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.43
AHR P35869 1/20 0.43
ABCG2 Q9UNQ0 1/20 0.43
HPGD P15428 2/20 0.42
GLA P06280 1/20 0.42
GAA P10253 1/20 0.42
TNKS O95271 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
SCHEMBL11311314 0.84 KDM4E (0.47) KDM4EALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL11309273 0.83 RAB9A (0.49) KDM4EALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL11321943 0.83 KDM4E (0.47) KDM4EALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL11323531 0.82 KDM4E (0.50) KDM4EALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL11321167 0.82 KDM4E (0.60) KDM4EALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL11324543 0.82 KDM4E (0.59) KDM4EALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL11328049 0.82 KDM4E (0.60) KDM4EALDH1A1SMN1; SMN2KMT2AHPGD
SCHEMBL11312503 0.82 PLK1 (0.64) KDM4EALDH1A1PLK1RAB9ALMNA
SCHEMBL11319576 0.81 ALDH1A1 (0.47) KDM4EALDH1A1PLK1KMT2ALMNA
SCHEMBL11310760 0.81 MAOB (0.55) KDM4EALDH1A1PLK1LMNAL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4189498-A FUNGICIDES, ARTHROPODICIDES BAYER AKTIENGESELLSCHAFT (DE) 1980-02-19 US claimed
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
EP-0000377-A1 Process for the preparation of chromone derivatives, new chromone derivatives and their use as plant-protecting agents BAYER AG (DE) 1979-01-24 EP disclosed