SCHEMBL31092018

SCHEMBL31092018

[2H]C(OC)(C(=O)c1ccccc1)C(=O)c1ccccc1CCCC

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 1/20 0.38
KMT2A Q03164 2/20 0.37
KDM4E B2RXH2 1/20 0.37
MEN1 O00255 1/20 0.37
RECQL P46063 1/20 0.37
ELANE P08246 1/20 0.37
CTRC Q99895 1/20 0.37
CYSLTR2 Q9NS75 6/20 0.36
CYSLTR1 Q9Y271 6/20 0.36
CES2 O00748 2/20 0.36
CES1 P23141 2/20 0.36
TSHR P16473 2/20 0.36
TDP1 Q9NUW8 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
ALDH1A1 P00352 1/20 0.36
LMNA P02545 1/20 0.36
TP53 P04637 1/20 0.35
CYP3A4 P08684 1/20 0.35
MAPK1 P28482 1/20 0.35
PGR P06401 1/20 0.35

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
SCHEMBL4868007 0.84 PPARA (0.39) PPARAKMT2AKDM4EMEN1RECQL
SCHEMBL11397191 0.76 TSHR (0.43) KMT2AKDM4EMEN1RECQLCYSLTR2
SCHEMBL30557597 0.75 ELANE (0.40) PPARAKMT2AKDM4EMEN1RECQL
SCHEMBL7164776 0.74 AKR1C3 (0.48) CES2CES1L3MBTL1ALDH1A1
SCHEMBL10607543 0.74 ALDH1A1 (0.43) PPARAKMT2AKDM4EMEN1RECQL
SCHEMBL31631736 0.73 CES2 (0.53) PPARACES2CES1
SCHEMBL8512473 0.72 LMNA (0.46) KMT2ACES2CES1TSHRTDP1
SCHEMBL4929020 0.72 NAAA (0.48) KMT2AKDM4EMEN1RECQLCYSLTR2
SCHEMBL165530 0.72 FOLH1 (0.61) PPARAKMT2AKDM4EMEN1RECQL
SCHEMBL10488478 0.72 PRSS1 (0.38) ELANECTRCCYSLTR2CYSLTR1CES2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118695840-A UV filter composition comprising closed cell metal oxide particles 巴斯夫欧洲公司 2024-09-24 CN disclosed
CN-118574599-A UV filter compositions comprising hybrid metal oxide particles 巴斯夫欧洲公司 2024-08-30 CN disclosed