SCHEMBL9747340

SCHEMBL9747340

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

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.36
XPO1 O14980 3/20 0.35
ADRA1A P35348 1/20 0.33
PDE4D Q08499 1/20 0.33
LMNA P02545 2/20 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
SCHEMBL9745938 0.79 TSHR (0.36) TSHRXPO1ADRA1APDE4DLMNA
SCHEMBL9746817 0.79 TSHR (0.36) TSHRXPO1ADRA1APDE4DLMNA
SCHEMBL9747111 0.78 ALDH1A1 (0.42) TSHR
SCHEMBL9745747 0.78 TSHR (0.39) TSHRXPO1ADRA1APDE4DLMNA
SCHEMBL666917 0.76 TSHR (0.40) TSHRXPO1ADRA1APDE4DLMNA
SCHEMBL640114 0.76 TSHR (0.40) TSHRXPO1ADRA1APDE4DLMNA
SCHEMBL26129905 0.76 TSHR (0.40) TSHRXPO1ADRA1APDE4DLMNA
SCHEMBL9746496 0.75 ALDH1A1 (0.44) TSHRLMNA
SCHEMBL1520934 0.74 TSHR (0.39) TSHRXPO1ADRA1APDE4DLMNA
SCHEMBL2065900 0.74 TSHR (0.39) TSHRXPO1ADRA1APDE4DLMNA

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-5100762-A Radiation-sensitive polymer and radiation-sensitive composition containing the same MITSUBISHI DENKI KABUSHIKI KAISHA (JP) 1992-03-31 US disclosed