SCHEMBL14756607

SCHEMBL14756607

C1OC1COC1CC2C3CCC(C3)[C@H]2C1

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.34
ALDH1A1 P00352 3/20 0.33
TDP1 Q9NUW8 1/20 0.32
TP53 P04637 1/20 0.32
CYP3A4 P08684 1/20 0.32
MAPK1 P28482 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
SCHEMBL2754962 1.00 TSHR (0.39) TSHRSMN1; SMN2ALDH1A1TDP1TP53
SCHEMBL17085515 0.80 TSHR (0.44) TSHRSMN1; SMN2ALDH1A1TDP1TP53
SCHEMBL7079859 0.80 TSHR (0.44) TSHRSMN1; SMN2ALDH1A1TDP1TP53
SCHEMBL12292918 0.80 TSHR (0.39) TSHRSMN1; SMN2ALDH1A1TDP1TP53
SCHEMBL14062955 0.79 TSHR (0.44) TSHRSMN1; SMN2ALDH1A1TDP1TP53
SCHEMBL14517851 0.79 TSHR (0.44) TSHRSMN1; SMN2ALDH1A1TDP1TP53
SCHEMBL3219541 0.78 TSHR (0.31) TSHR
SCHEMBL12292923 0.78 TSHR (0.32) TSHR
SCHEMBL9947140 0.78 TSHR (0.40) TSHRSMN1; SMN2ALDH1A1TDP1TP53
SCHEMBL732071 0.76 TSHR (0.46) TSHRSMN1; SMN2ALDH1A1TDP1TP53

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
WO-2013032034-A1 COLORED COMPOSITION, METHOD OF PRODUCING COLOR FILTER USING THE SAME, COLOR FILTER AND SOLID-STATE IMAGING DEVICE FUJIFILM CORPORATION (JP) 2013-03-07 WO disclosed