SCHEMBL25754313

SCHEMBL25754313

CCOCCOCCn1cccc1

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.39
TP53 P04637 1/20 0.33
HRH1 P35367 1/20 0.33
KDM4E B2RXH2 2/20 0.33
HTT P42858 1/20 0.33
TSHR P16473 2/20 0.32
MGLL Q99685 1/20 0.31

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
SCHEMBL8050553 0.95 ALDH1A1 (0.36) ALDH1A1TP53KDM4ETSHR
SCHEMBL30301314 0.93 ALDH1A1 (0.35) ALDH1A1TP53KDM4ETSHR
SCHEMBL12376948 0.83 TSHR (0.41) ALDH1A1KDM4EHTTTSHR
SCHEMBL12955854 0.82 KDM4E (0.33) ALDH1A1TP53KDM4EHTTTSHR
SCHEMBL1244576 0.80 TSHR (0.43) ALDH1A1KDM4EHTTTSHR
SCHEMBL25753069 0.77 MEN1 (0.50) ALDH1A1TP53HRH1HTTTSHR
SCHEMBL30365456 0.77 TP53 (0.33) TP53MGLL
SCHEMBL5148219 0.74 ALDH1A1 (0.68) ALDH1A1KDM4ETSHR
SCHEMBL5032553 0.73 TP53 (0.33) TP53
SCHEMBL2608876 0.71 TP53 (0.32) TP53

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
US-20230193067-A1 METAL OXIDE COMPOSITION, LIGHT-EMITTING DEVICE USING THE SAME, AND ELECTRONIC APPARATUS INCLUDING THE LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2023-06-22 US disclosed
CN-104167564-B Nonaqueous electrolyte solution and nonaqueous electrolyte secondary battery 三菱化学株式会社 2017-04-12 CN disclosed