SCHEMBL21385283

SCHEMBL21385283

CCOC(=O)C(C)=CC1(CC)COC1

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GLO1 Q04760 1/20 0.38
ALDH1A1 P00352 6/20 0.35
CYP2D6 P10635 2/20 0.35
GAA P10253 1/20 0.35
CYP2C19 P33261 1/20 0.35
NPSR1 Q6W5P4 2/20 0.34
LMNA P02545 3/20 0.33
HSD17B10 Q99714 1/20 0.33
ATM Q13315 1/20 0.33
MAPT P10636 3/20 0.32
TSHR P16473 2/20 0.32
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
S1PR4 O95977 1/20 0.31
S1PR1 P21453 1/20 0.31
MAPK1 P28482 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
TRPA1 O75762 1/20 0.31
KDM4E B2RXH2 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
SCHEMBL21385282 0.87 HCAR2 (0.32) TSHR
SCHEMBL18205741 0.86
SCHEMBL631548 0.85
SCHEMBL782181 0.79
SCHEMBL29935410 0.72
SCHEMBL13901492 0.72 ALDH1A1 (0.40) GLO1ALDH1A1CYP2D6GAACYP2C19
SCHEMBL23225587 0.71 NPSR1 (0.36) GLO1ALDH1A1CYP2D6GAACYP2C19
SCHEMBL28735700 0.70
SCHEMBL28534929 0.69 PPARG (0.33) TSHR
SCHEMBL20769756 0.68

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
CN-114149530-B Alkali-soluble polymer for preparing LDI dry film and preparation method thereof 保定乐凯新材料股份有限公司 2023-07-21 CN disclosed
CN-111936524-B Photochromic curable composition 株式会社德山 2022-09-23 CN disclosed
CN-114149530-A Alkali-soluble polymer for preparing LDI dry film and preparation method thereof 保定乐凯新材料股份有限公司 2022-03-08 CN disclosed
CN-114153122-A Cationic free radical polymerization composition for preparing LDI dry film and LDI dry film 保定乐凯新材料股份有限公司 2022-03-08 CN disclosed
CN-111936524-A Photochromic curable composition 株式会社德山 2020-11-13 CN disclosed
WO-2019182085-A1 PHOTOCHROMIC CURABLE COMPOSITION 株式会社トクヤマ 2019-09-26 WO disclosed