SCHEMBL11345947

SCHEMBL11345947

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

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HCRTR1 O43613 1/20 0.46
▸ ALDH1A1 P00352 3/20 0.43
▸ HPGD P15428 2/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ NPC1 O15118 1/20 0.43
▸ RAB9A P51151 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ PPARG P37231 2/20 0.43
▸ PPARA Q07869 2/20 0.43
▸ AR P10275 1/20 0.43
▸ ALDH2 P05091 1/20 0.42
▸ HTT P42858 1/20 0.42
▸ L3MBTL1 Q9Y468 2/20 0.42
▸ LMNA P02545 2/20 0.42
▸ SIRT1 Q96EB6 1/20 0.42
▸ AHR P35869 1/20 0.41
▸ ACHE P22303 1/20 0.40
▸ PLA2G4A P47712 1/20 0.40
▸ MAPT P10636 2/20 0.40
▸ TP53 P04637 1/20 0.40

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
SCHEMBL11340277 0.95 HCRTR1 (0.45) HCRTR1ALDH1A1HPGDPPARGPPARA
SCHEMBL11339147 0.93 HTT (0.48) ALDH2HTTACHEKDM4E
SCHEMBL11346947 0.90 ALDH2 (0.43) HCRTR1ALDH1A1HPGDMEN1NPC1
SCHEMBL11363873 0.90 TDP1 (0.44) ALDH1A1HPGDKMT2AALDH2HTT
SCHEMBL11340905 0.87 HCRTR1 (0.46) HCRTR1ALDH1A1HPGDMEN1RAB9A
SCHEMBL11338343 0.86 PPARG (0.47) ALDH1A1PPARGPPARAHTTL3MBTL1
SCHEMBL11342495 0.86 MCL1 (0.49) HCRTR1ALDH1A1HPGDKMT2AAHR
SCHEMBL11351127 0.85 HTT (0.46) ALDH2HTTACHEKDM4E
SCHEMBL11340659 0.84 HCRTR1 (0.43) HCRTR1ALDH1A1HPGDPPARGPPARA
SCHEMBL11351192 0.83 NPC1 (0.43) ALDH1A1HPGDMEN1NPC1RAB9A

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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