SCHEMBL21081997

SCHEMBL21081997

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

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 2/20 0.35
TSHR P16473 3/20 0.34
ALDH1A1 P00352 2/20 0.34
TP53 P04637 2/20 0.34
HIF1A Q16665 2/20 0.34
HSD17B10 Q99714 2/20 0.34
ATM Q13315 1/20 0.33
GSTP1 P09211 1/20 0.33
LPAR5 Q9H1C0 1/20 0.32
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
KDM4E B2RXH2 1/20 0.30
LMNA P02545 1/20 0.30
CYP1A2 P05177 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
USP2 O75604 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
SCHEMBL26109047 1.00 HCAR2 (0.35) HCAR2TSHRALDH1A1TP53HIF1A
SCHEMBL21081994 1.00 HCAR2 (0.35) HCAR2TSHRALDH1A1TP53HIF1A
SCHEMBL144845 0.98 HCAR2 (0.36) HCAR2TSHRALDH1A1TP53HIF1A
SCHEMBL28138681 0.91 HSD17B10 (0.42) HCAR2HSD17B10ATMLPAR5MEN1
SCHEMBL1046295 0.91 LPAR5 (0.41) HCAR2TSHRALDH1A1HSD17B10ATM
SCHEMBL996290 0.91 LPAR5 (0.37) HCAR2TSHRALDH1A1HSD17B10ATM
SCHEMBL5535259 0.91 TSHR (0.35) HCAR2TSHRALDH1A1ATMGSTP1
SCHEMBL347488 0.91 TSHR (0.35) HCAR2TSHRALDH1A1ATMGSTP1
SCHEMBL21081953 0.90 LPAR5 (0.43) HCAR2TSHRALDH1A1ATMLPAR5
SCHEMBL21081952 0.90 LPAR5 (0.43) HCAR2TSHRALDH1A1ATMLPAR5

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-3505344-A1 ANTIFOG LAMINATE Mitsui Chemicals, Inc. (JP) 2019-07-03 EP disclosed
EP-3505345-A1 ANTIREFLECTIVE LAMINATE Mitsui Chemicals, Inc. (JP) 2019-07-03 EP disclosed