SCHEMBL20926869

SCHEMBL20926869

CC(=O)C(C)(C)CCOC(C)(C)CCNC(=O)CCN1C(=O)CC(C)C1=O

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 1/20 0.33
▸ HTT P42858 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ POLB P06746 1/20 0.31
▸ HSD17B10 Q99714 1/20 0.31
▸ CYP3A4 P08684 1/20 0.31
▸ CYP2C19 P33261 1/20 0.31
▸ TSHR P16473 1/20 0.30
▸ ALDH1A1 P00352 1/20 0.30

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
SCHEMBL10086140 0.89 HPGD (0.33) HPGDHTTSMN1; SMN2POLBHSD17B10
SCHEMBL24340751 0.88 SMN1; SMN2 (0.41) HPGDHTTSMN1; SMN2POLBCYP2C19
SCHEMBL20056990 0.87 HPGD (0.34) HPGDHTTSMN1; SMN2POLBHSD17B10
SCHEMBL21727787 0.86 HPGD (0.33) HPGDHTTSMN1; SMN2POLBHSD17B10
SCHEMBL20926880 0.86 HPGD (0.33) HPGDHTTSMN1; SMN2POLBHSD17B10
SCHEMBL20057063 0.80 ALDH1A1 (0.35) HPGDHTTSMN1; SMN2POLBHSD17B10
SCHEMBL13670141 0.79 HTT (0.42) HPGDHTTSMN1; SMN2POLBHSD17B10
SCHEMBL26049697 0.79 HPGD (0.30) HPGDHTTSMN1; SMN2HSD17B10ALDH1A1
SCHEMBL24826692 0.79 POLB (0.33) HPGDHTTSMN1; SMN2POLBHSD17B10
SCHEMBL24860019 0.79 POLB (0.33) HPGDHTTSMN1; SMN2POLBHSD17B10

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-20190120856-A1 DETECTION OF SYMMETRICAL DIMETHYLARGININE IDEXX LABORATORIES, INC. 2019-04-25 — — US disclosed
Send feedback