SCHEMBL11340659

SCHEMBL11340659

CC(Oc1ccc2c(c1)oc1cc(C(F)(F)F)ccc12)C(=O)OCCOc1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ HCRTR1 O43613 1/20 0.43
▸ ALDH1A1 P00352 2/20 0.41
▸ HPGD P15428 1/20 0.41
▸ PPARD Q03181 3/20 0.41
▸ PPARA Q07869 4/20 0.41
▸ PPARG P37231 4/20 0.41
▸ AR P10275 1/20 0.41
▸ ALDH2 P05091 1/20 0.40
▸ SIRT1 Q96EB6 1/20 0.40
▸ LMNA P02545 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ MAOB P27338 1/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ GAA P10253 1/20 0.39
▸ MCL1 Q07820 1/20 0.39
▸ ACHE P22303 1/20 0.38

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
SCHEMBL11336713 0.89 HTT (0.43) PPARGMAOB
SCHEMBL11343847 0.85 KDM4E (0.42) ALDH1A1PPARAPPARGARALDH2
SCHEMBL11338343 0.85 PPARG (0.47) ALDH1A1PPARAPPARGL3MBTL1MAOB
SCHEMBL11345947 0.84 HCRTR1 (0.46) HCRTR1ALDH1A1HPGDPPARAPPARG
SCHEMBL11340905 0.84 HCRTR1 (0.46) HCRTR1ALDH1A1HPGDPPARAPPARG
SCHEMBL10638299 0.82 LMNA (0.48) PPARDPPARAPPARGLMNAL3MBTL1
SCHEMBL11349573 0.81 KCNA3 (0.45) ALDH1A1PPARAPPARGARLMNA
SCHEMBL11340277 0.79 HCRTR1 (0.45) HCRTR1ALDH1A1HPGDPPARDPPARA
SCHEMBL11346450 0.78 TDP1 (0.41) HCRTR1ALDH1A1HPGDARALDH2
SCHEMBL11339147 0.77 HTT (0.48) ALDH2MAOBKDM4EACHE

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
EP-0035744-A1 Dibenzo-furane-oxyalkane carboxylic acid esters, process for their preparation, herbicides containing them and their use as herbicides BASF Aktiengesellschaft (DE) 1981-09-16 — — EP claimed
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