SCHEMBL29291352

SCHEMBL29291352

CCN(CCO)CC(O)COCCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F

nearest known ligand 0.38

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.38
LMNA P02545 2/20 0.36
USP2 O75604 1/20 0.31
NPSR1 Q6W5P4 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
SCHEMBL3386278 0.80 HIF1A (0.33) LMNA
SCHEMBL17925008 0.78
SCHEMBL3000175 0.76 USP2 (0.40) USP2
SCHEMBL2992526 0.76 USP2 (0.40) USP2
SCHEMBL2605896 0.76 HSD17B10 (0.30)
SCHEMBL13291498 0.71 ALDH1A1 (0.42) ALDH1A1LMNANPSR1
SCHEMBL29573656 0.71
SCHEMBL10642986 0.70 KDM4E (0.35)
SCHEMBL23587817 0.70 LMNA (0.53) ALDH1A1LMNAUSP2
SCHEMBL30916813 0.69 HSD17B10 (0.41)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110028412-B Perfluoro-substituted micromolecule end group diol and preparation method and application thereof 南京信息工程大学 2021-11-30 CN disclosed