SCHEMBL28281999

SCHEMBL28281999

Cc1cc(C)c(C2COC(C(=O)C=O)CO2)c(C)c1

nearest known ligand 0.31

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ TAS1R3 Q7RTX0 2/20 0.31
▸ TAS1R1 Q7RTX1 2/20 0.31
▸ TAS1R2 Q8TE23 2/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ GAPDH P04406 1/20 0.31
▸ POLB P06746 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ TDP1 Q9NUW8 1/20 0.31
▸ L3MBTL1 Q9Y468 1/20 0.31

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
SCHEMBL13385205 0.77 RAPGEF4 (0.35) MEN1GAPDHPOLBKMT2ATDP1
SCHEMBL28282049 0.71 ALDH1A1 (0.35) POLBTDP1
SCHEMBL10029274 0.71 — —
SCHEMBL28283499 0.69 MAPT (0.35) MEN1GAPDHPOLBKMT2ATDP1
SCHEMBL28283565 0.69 THRA (0.38) —
SCHEMBL28281952 0.67 GSTO1 (0.32) —
SCHEMBL28328771 0.67 CHRM2 (0.31) —
SCHEMBL28870581 0.64 KDM4E (0.30) —
SCHEMBL3458160 0.64 ALDH1A1 (0.34) L3MBTL1
SCHEMBL17141371 0.64 TSHR (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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109553707-A A kind of catalytic component, catalyst and application for olefinic polymerization 中国石油化工股份有限公司 2019-04-02 — — CN disclosed
CN-109553709-A A kind of catalytic component and its catalyst for olefinic polymerization 中国石油化工股份有限公司 2019-04-02 — — CN disclosed
CN-109553708-A A kind of catalytic component and preparation method thereof for olefinic polymerization 中国石油化工股份有限公司 2019-04-02 — — CN disclosed
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