SCHEMBL9876544

SCHEMBL9876544

C=C(C)C(=O)OC(F)CC(F)(F)C(F)(F)C(F)(F)C(F)F

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.33
GAA P10253 1/20 0.33
KDM4E B2RXH2 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
ALDH1A1 P00352 1/20 0.31
USP2 O75604 1/20 0.31
MAPT P10636 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
SCHEMBL5006288 0.94 TSHR (0.37) TSHRGAAKDM4ETDP1USP2
SCHEMBL17159900 0.94 TSHR (0.37) TSHRGAAKDM4ETDP1USP2
SCHEMBL9348325 0.85 TSHR (0.34) TSHRALDH1A1
SCHEMBL2274473 0.84 TSHR (0.33) TSHRALDH1A1
SCHEMBL6259835 0.84 TSHR (0.33) TSHRALDH1A1
SCHEMBL145573 0.81 TSHR (0.38) TSHRALDH1A1
Methacrylic Acid SCHEMBL17242451 0.80 TSHR (0.31) TSHR
SCHEMBL183807 0.79 TSHR (0.42) TSHRGAAKDM4ETDP1ALDH1A1
SCHEMBL28724941 0.78 GAA (0.35) TSHRGAAKDM4ETDP1ALDH1A1
SCHEMBL4108841 0.78 TSHR (0.39) TSHRGAAKDM4ETDP1ALDH1A1

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
US-5064695-A Method for forming coating film MITSUBISHI RAYON CO., LTD. (JP) 1991-11-12 US disclosed