SCHEMBL21082001

SCHEMBL21082001

CC=CC(=O)OCC(O)COCCOCC(CC)OCC(O)COC(=O)C=CC

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.33
LPAR5 Q9H1C0 1/20 0.32
HCAR2 Q8TDS4 2/20 0.32
P2RY10 O00398 1/20 0.31
USP2 O75604 1/20 0.30
CYP1A2 P05177 1/20 0.30
CYP3A4 P08684 1/20 0.30
CYP2C19 P33261 1/20 0.30
TSHR P16473 1/20 0.30

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
SCHEMBL651674 0.94 ATM (0.32) ATMHCAR2TSHR
SCHEMBL997670 0.87 GSTP1 (0.33) ATMTSHR
SCHEMBL144845 0.87 HCAR2 (0.36) ATMLPAR5HCAR2USP2CYP1A2
SCHEMBL21081994 0.85 HCAR2 (0.35) ATMLPAR5HCAR2USP2CYP1A2
SCHEMBL21081997 0.85 HCAR2 (0.35) ATMLPAR5HCAR2USP2CYP1A2
SCHEMBL26109047 0.85 HCAR2 (0.35) ATMLPAR5HCAR2USP2CYP1A2
SCHEMBL28138681 0.84 HSD17B10 (0.42) ATMLPAR5HCAR2P2RY10USP2
SCHEMBL19834168 0.83 KDM4E (0.32)
SCHEMBL5575700 0.82 ATM (0.49) ATMLPAR5HCAR2P2RY10USP2
SCHEMBL996290 0.81 LPAR5 (0.37) ATMLPAR5HCAR2P2RY10USP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11338562-B2 Antifogging laminate MITSUI CHEMICALS, INC. (JP) 2022-05-24 US disclosed
US-20210284862-A1 Antireflective Laminate MITSUI CHEMICALS, INC. (JP) 2021-09-16 US disclosed
US-20190202184-A1 ANTIFOGGING LAMINATE MITSUI CHEMICALS, INC. (JP) 2019-07-04 US disclosed
EP-3505345-A1 ANTIREFLECTIVE LAMINATE Mitsui Chemicals, Inc. (JP) 2019-07-03 EP disclosed
EP-3505344-A1 ANTIFOG LAMINATE Mitsui Chemicals, Inc. (JP) 2019-07-03 EP disclosed