SCHEMBL7564346

SCHEMBL7564346

O=C(Oc1ccccc1)C(=CCc1ccccc1)c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ELANE P08246 3/20 0.40
▸ NR4A2 P43354 2/20 0.40
▸ KMT2A Q03164 3/20 0.39
▸ TDP1 Q9NUW8 2/20 0.39
▸ SLC6A2 P23975 1/20 0.39
▸ SLC6A3 Q01959 1/20 0.39
▸ ALOX15 P16050 1/20 0.38
▸ MAOB P27338 1/20 0.38
▸ MAPT P10636 2/20 0.37
▸ KDM4E B2RXH2 2/20 0.37
▸ ALDH1A1 P00352 2/20 0.37
▸ HPGD P15428 1/20 0.37
▸ LMNA P02545 1/20 0.37
▸ CYP19A1 P11511 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ SMPD1 P17405 1/20 0.36
▸ AKR1C1 Q04828 1/20 0.36
▸ NPC1 O15118 1/20 0.36

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
SCHEMBL28958208 0.82 ELANE (0.45) ELANEKMT2ATDP1ALOX15MAPT
SCHEMBL11895095 0.81 ELANE (0.40) ELANEKMT2ATDP1ALOX15MAPT
SCHEMBL20563856 0.79 TBXAS1 (0.44) ELANENR4A2TDP1ALOX15KDM4E
SCHEMBL27404982 0.79 AKT1 (0.47) ELANEKMT2ATDP1ALOX15MAPT
SCHEMBL27395781 0.79 AKR1C1 (0.52) KMT2ATDP1SLC6A2SLC6A3ALOX15
SCHEMBL9796848 0.79 AKR1C1 (0.52) KMT2ATDP1SLC6A2SLC6A3ALOX15
SCHEMBL27918620 0.79 KMT2A (0.41) ELANEKMT2AMAOBMAPTALDH1A1
SCHEMBL28097790 0.78 ELANE (0.42) ELANEKMT2ATDP1ALOX15MAPT
SCHEMBL11694931 0.78 ELANE (0.45) ELANEKMT2ATDP1ALOX15MAPT
SCHEMBL4405818 0.77 ELANE (0.45) ELANEKMT2ATDP1MAPTKDM4E

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
EP-0885061-B1 CHITIN OR CHITIN DERIVATIVE MICROCAPSULES CONTAINING A HYDROPHOBIC SUBSTANCE, PARTICULARLY A SUN FILTER AND METHOD FOR PREPARING SUCH MICROCAPSULES MERCK S A (FR) 2002-02-20 — — EP claimed
EP-0885061-A1 CHITIN OR CHITIN DERIVATIVE MICROCAPSULES CONTAINING A HYDROPHOBIC SUBSTANCE, PARTICULARLY A SUN FILTER AND METHOD FOR PREPARING SUCH MICROCAPSULES MERCK S.A. (FR) 1998-12-23 — — EP claimed
WO-1998022210-A1 CHITIN OR CHITIN DERIVATIVE MICROCAPSULES CONTAINING A HYDROPHOBIC SUBSTANCE, PARTICULARLY A SUN FILTER AND METHOD FOR PREPARING SUCH MICROCAPSULES MERCK S.A. (FR) 1998-05-28 — — WO claimed
EP-0885061-B1 CHITIN OR CHITIN DERIVATIVE MICROCAPSULES CONTAINING A HYDROPHOBIC SUBSTANCE, PARTICULARLY A SUN FILTER AND METHOD FOR PREPARING SUCH MICROCAPSULES MERCK S A (FR) 2002-02-20 — — EP disclosed
EP-0885061-A1 CHITIN OR CHITIN DERIVATIVE MICROCAPSULES CONTAINING A HYDROPHOBIC SUBSTANCE, PARTICULARLY A SUN FILTER AND METHOD FOR PREPARING SUCH MICROCAPSULES MERCK S.A. (FR) 1998-12-23 — — EP disclosed
WO-1998022210-A1 CHITIN OR CHITIN DERIVATIVE MICROCAPSULES CONTAINING A HYDROPHOBIC SUBSTANCE, PARTICULARLY A SUN FILTER AND METHOD FOR PREPARING SUCH MICROCAPSULES MERCK S.A. (FR) 1998-05-28 — — WO disclosed
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