SCHEMBL18545341

SCHEMBL18545341

C=C(C)C(=O)OCCC(C)(C)OCCC(C)(C)OC(=O)C(=C)C

nearest known ligand 0.43

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.43
TSHR P16473 3/20 0.42
ALDH1A1 P00352 2/20 0.34
POLB P06746 1/20 0.33
APEX1 P27695 1/20 0.33
HTT P42858 1/20 0.33
TDP1 Q9NUW8 1/20 0.33

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
SCHEMBL1960823 0.93 THRB (0.48) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL25908140 0.89 LMNA (0.33) THRBTSHR
SCHEMBL18401055 0.89 THRB (0.42) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL27375881 0.88 THRB (0.44) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL18860205 0.88 THRB (0.39) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL24221990 0.87 THRB (0.43) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL22013202 0.87 ALDH1A1 (0.36) THRBTSHRALDH1A1
SCHEMBL17052435 0.86 THRB (0.41) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL10049532 0.85 THRB (0.37) THRBTSHRALDH1A1
SCHEMBL21555723 0.84 TSHR (0.49) THRBTSHRALDH1A1POLBAPEX1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11642841-B2 Indirect additive manufacturing process UT-BATTELLE, LLC (US) 2023-05-09 US disclosed
US-10570439-B2 Sample concentration devices Monolythix, Inc. (US) 2020-02-25 US disclosed
US-20190111618-A1 INDIRECT ADDITIVE MANUFACTURING PROCESS UT-BATTELLE, LLC 2019-04-18 US disclosed
US-20170051273-A1 SAMPLE CONCENTRATION DEVICES Monolythix, Inc. (US) 2017-02-23 US disclosed