SCHEMBL28101052

SCHEMBL28101052

CCOC(F)(C(=O)O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F

nearest known ligand 0.45

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.45
KDM4E B2RXH2 1/20 0.33
POLB P06746 1/20 0.33
MAPT P10636 1/20 0.33
KMT2A Q03164 1/20 0.33

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
SCHEMBL13597406 0.92 THRB (0.38) THRBKDM4EPOLBMAPTKMT2A
SCHEMBL9323503 0.83 FAAH (0.32) THRBPOLBKMT2A
Ammonia Solution, Strong SCHEMBL29544342 0.81 FAAH (0.31) THRBPOLBKMT2A
SCHEMBL236460 0.70 ALOX15 (0.33) KMT2A
SCHEMBL9348121 0.70 LMNA (0.32) THRBPOLB
SCHEMBL1687014 0.69 LMNA (0.33)
SCHEMBL1686972 0.69 LMNA (0.33)
SCHEMBL1687090 0.69 LMNA (0.33)
SCHEMBL3273446 0.69 LMNA (0.33)
SCHEMBL1686979 0.69 LMNA (0.33)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106117046-A The synthetic method of medical material 2-ethoxy perfluoro caprylic acid 无锡乾浩生物医药有限公司 2016-11-16 CN claimed
CN-106117046-A The synthetic method of medical material 2-ethoxy perfluoro caprylic acid 无锡乾浩生物医药有限公司 2016-11-16 CN disclosed
CN-106117046-A The synthetic method of medical material 2-ethoxy perfluoro caprylic acid 无锡乾浩生物医药有限公司 2016-11-16 CN disclosed
CN-106117046-A The synthetic method of medical material 2-ethoxy perfluoro caprylic acid 无锡乾浩生物医药有限公司 2016-11-16 CN disclosed