SCHEMBL28296900

SCHEMBL28296900

CCCc1nc(C)c[nH]1.F[B-](F)(F)F

nearest known ligand 0.31

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GLA P06280 1/20 0.31
PDK2 Q15119 1/20 0.31
ADORA3 P0DMS8 2/20 0.30
ADORA2A P29274 2/20 0.30
ADORA1 P30542 2/20 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
SCHEMBL542826 0.92
SCHEMBL14744378 0.91 HRH3 (0.38)
Iodide SCHEMBL633579 0.90 GLA (0.34) GLAPDK2ADORA2AADORA1
Methane SCHEMBL28186517 0.90 GLA (0.34) GLAPDK2ADORA2AADORA1
SCHEMBL27513234 0.89 HRH3 (0.37)
SCHEMBL27625929 0.88 GLA (0.31) GLAPDK2
SCHEMBL2023841 0.86 ADORA1 (0.34) ADORA1
Propene SCHEMBL28218434 0.82 GLA (0.31) GLAPDK2
SCHEMBL2037718 0.82 HRH3 (0.42)
SCHEMBL5897906 0.80 ALDH1A1 (0.43)

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-107129654-B A kind of internal plasticization antistatic polyoxymethylene material and preparation method thereof 杭州师范大学 2019-06-18 CN disclosed
CN-109796723-A A kind of antistatic, rub resistance and wear-resistant polyformaldehyde material and preparation method thereof 杭州师范大学 2019-05-24 CN disclosed