SCHEMBL28299910

SCHEMBL28299910

CC=CCCC=C(C)C#N

nearest known ligand 0.37

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.37
KMT2A Q03164 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
SCHEMBL6699206 0.85 TDP1 (0.35) KMT2A
SCHEMBL28079328 0.80 PPARA (0.32) KMT2A
SCHEMBL10789764 0.73
SCHEMBL10789771 0.73
SCHEMBL17811841 0.73
SCHEMBL8343220 0.72
SCHEMBL9246160 0.72
SCHEMBL7945056 0.70 KMT2A (0.52) TSHRKMT2A
SCHEMBL7945058 0.70 KMT2A (0.52) TSHRKMT2A
SCHEMBL10556865 0.70

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-109803632-A High performance, high impact strength fragrance emitting accord 国际香料和香精公司 2019-05-24 CN disclosed