SCHEMBL28296545

SCHEMBL28296545

CCCCC(COC(C)(C)C)OC(C)(C)C

nearest known ligand 0.37

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.37
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
TSHR P16473 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
DNM1 Q05193 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
SCHEMBL30549092 0.87 MAPK1 (0.39) MAPK1
SCHEMBL12140601 0.80 CA2 (0.38) MAPK1CA1CA2TSHRSMN1; SMN2
SCHEMBL755226 0.79 MAPK1 (0.48) MAPK1
SCHEMBL25959871 0.78 MAPK1 (0.39) MAPK1
SCHEMBL15760607 0.78 MAPK1 (0.42) MAPK1
SCHEMBL17085245 0.78 MAPK1 (0.42) MAPK1
SCHEMBL16368826 0.78 MAPK1 (0.42) MAPK1
SCHEMBL20995928 0.78 MAPK1 (0.42) MAPK1
SCHEMBL19543096 0.78 MAPK1 (0.42) MAPK1
SCHEMBL19543658 0.78 MAPK1 (0.42) MAPK1

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-116670108-A Ether compounds as volatiles for treating amino acid based substrates such as skin and hair 迈图高新材料有限责任公司 2023-08-29 CN disclosed
CN-109704930-A The method and fuel oil additive of high selectivity dihydric alcohol di-tert-butyl ether 深圳市前海博扬研究院有限公司 2019-05-03 CN disclosed