SCHEMBL16776308

SCHEMBL16776308

C=CC(=O)OCCOC(=O)NC1CCC2(CC1)C1C2C12CCC(NC(=O)OCCOC(=O)C=C)CC2

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 6/20 0.42
ALDH1A1 P00352 4/20 0.42
TP53 P04637 2/20 0.42
HIF1A Q16665 2/20 0.42
HSD17B10 Q99714 1/20 0.42
EPHX1 P07099 3/20 0.40
CYP3A4 P08684 1/20 0.39
HPGD P15428 1/20 0.36
THRB P10828 2/20 0.34
KCNA3 P22001 1/20 0.32
GAA P10253 2/20 0.32
MAPK1 P28482 1/20 0.32
HTT P42858 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
NAAA Q02083 1/20 0.30
ASAH1 Q13510 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
SCHEMBL2436673 0.82 EPHX1 (0.59) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL22190104 0.81 EPHX1 (0.47) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL11510008 0.79 TSHR (0.44) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL21304404 0.79 EPHX1 (0.46) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL19001407 0.76 EPHX1 (0.49) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL22190108 0.75 EPHX1 (0.42) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL16375422 0.74 TSHR (0.50) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL18623651 0.74 TSHR (0.42) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL18485517 0.74 EPHX1 (0.44) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL15893893 0.74 EPHX1 (0.47) TSHRALDH1A1TP53HIF1AHSD17B10

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-20150155106-A1 AGENT FOR FORMING ELECTRODE PROTECTION FILM SANYO CHEMICAL INDUSTRIES, LTD. (JP) 2015-06-04 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20150155106-A1 AGENT FOR FORMING ELECTRODE PROTECTION FILM HCN2, NIBAN2, F10 TSHR 4579/4885ALDH1A1 2150/4885TP53 4676/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.