SCHEMBL16625921

SCHEMBL16625921

OC1CCC(C2CCCC(C3CCC(O)CC3)C2)CC1

nearest known ligand 0.42

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.42
ALDH1A1 P00352 1/20 0.39
ESR2 Q92731 1/20 0.31
ALOX5 P09917 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
SCHEMBL13434713 0.89 TSHR (0.45) TSHRALDH1A1ESR2
SCHEMBL9909854 0.88 ALDH1A1 (0.39) TSHRALDH1A1ALOX5
SCHEMBL26663722 0.87
SCHEMBL4569171 0.85 TSHR (0.37) TSHR
SCHEMBL14159019 0.84 TSHR (0.41) TSHR
SCHEMBL2450232 0.84 TSHR (0.60) TSHRALDH1A1ESR2
SCHEMBL12876612 0.84 TSHR (0.60) TSHRALDH1A1ESR2
SCHEMBL15612484 0.84 ALDH1A1 (0.54) ALDH1A1ALOX5
SCHEMBL9035146 0.82 ALDH1A1 (0.47) TSHRALDH1A1ALOX5
SCHEMBL7377837 0.82 ALDH1A1 (0.47) TSHRALDH1A1ALOX5

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
US-20150098046-A1 POLARIZING PLATE PROTECTIVE FILM, POLARIZING PLATE, LIQUID CRYSTAL DISPLAY DEVICE, AND PRODUCTION METHOD OF POLARIZING PLATE PROTECTIVE FILM FUJIFILM CORPORATION (JP) 2015-04-09 US disclosed
US-20150098046-A1 POLARIZING PLATE PROTECTIVE FILM, POLARIZING PLATE, LIQUID CRYSTAL DISPLAY DEVICE, AND PRODUCTION METHOD OF POLARIZING PLATE PROTECTIVE FILM FUJIFILM CORPORATION (JP) 2015-04-09 US disclosed