SCHEMBL15078271

SCHEMBL15078271

C=CC(=O)OCCNC(=O)OC1C2CCC3C1OS(=O)(=O)C3C2

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.31
CYP3A4 P08684 1/20 0.31
TSHR P16473 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
SCHEMBL15078361 0.92 TSHR (0.32) ALDH1A1CYP3A4TSHR
SCHEMBL15078259 0.85
SCHEMBL12602341 0.84 TSHR (0.33) ALDH1A1CYP3A4TSHR
SCHEMBL15078265 0.82
SCHEMBL12602333 0.82
SCHEMBL15078350 0.80 TSHR (0.33) ALDH1A1CYP3A4TSHR
SCHEMBL15078378 0.78 TSHR (0.32) ALDH1A1CYP3A4TSHR
SCHEMBL15078172 0.78 ALDH1A1 (0.31) ALDH1A1CYP3A4TSHR
SCHEMBL15078274 0.78
SCHEMBL7010130 0.78 ALDH1A1 (0.31) ALDH1A1CYP3A4TSHR

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-9152042-B2 Acrylic ester derivative, high-molecular compound and photoresist composition KURARAY CO., LTD. (JP) 2015-10-06 US disclosed
US-20130164675-A1 ACRYLIC ESTER DERIVATIVE, HIGH-MOLECULAR COMPOUND AND PHOTORESIST COMPOSITION KURARAY CO., LTD. (JP) 2013-06-27 US disclosed