SCHEMBL21711136

SCHEMBL21711136

C=CC(=O)NC(COC(=O)C=C)(COC(=O)C=C)COC(=O)C=C

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.52
TP53 P04637 3/20 0.52
HIF1A Q16665 3/20 0.52
CYP3A4 P08684 3/20 0.52
MAPK1 P28482 2/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
TSHR P16473 9/20 0.42
HSD17B10 Q99714 1/20 0.42
THRB P10828 2/20 0.40
HPGD P15428 1/20 0.38
TDP1 Q9NUW8 1/20 0.37
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
MAPT P10636 1/20 0.31
CACNA1B Q00975 1/20 0.31
APBA1 Q02410 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
SCHEMBL14366076 0.91 ALDH1A1 (0.56) ALDH1A1TP53HIF1ACYP3A4MAPK1
SCHEMBL16309294 0.86 ALDH1A1 (0.53) ALDH1A1TP53HIF1ACYP3A4MAPK1
SCHEMBL6036636 0.84 ALDH1A1 (0.38) ALDH1A1TP53HIF1ACYP3A4MAPK1
SCHEMBL17522061 0.81 ALDH1A1 (0.48) ALDH1A1TP53HIF1ACYP3A4MAPK1
SCHEMBL17522074 0.81 ALDH1A1 (0.48) ALDH1A1TP53HIF1ACYP3A4MAPK1
SCHEMBL14268071 0.80 THRB (0.39) ALDH1A1TP53HIF1ACYP3A4MAPK1
SCHEMBL14195296 0.80 THRB (0.39) ALDH1A1TP53HIF1ACYP3A4MAPK1
SCHEMBL16309292 0.79 ALDH1A1 (0.47) ALDH1A1TP53HIF1ACYP3A4MAPK1
SCHEMBL21776173 0.79 ALDH1A1 (0.41) ALDH1A1TP53HIF1ACYP3A4MAPK1
SCHEMBL22215979 0.78 TSHR (0.39) ALDH1A1TP53HIF1ACYP3A4MAPK1

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-10647659-B2 Process for productions of formamides and acrylamides SHENZHEN YOUWEI TECHNOLOGY HOLDINGS GROUP CO., LTD. (CN) 2020-05-12 US disclosed
US-20200048186-A1 Process for Productions of Formamides and Acrylamides SHENZHEN YOUWEI TECHNOLOGY HOLDINGS GROUP CO.,LTD. (CN) 2020-02-13 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 (2 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-10647659-B2 Process for productions of formamides and acrylamides PFAS, FASN, AGPS ALDH1A1 472/4885TP53 3482/4885HIF1A 2831/4885
US-20200048186-A1 Process for Productions of Formamides and Acrylamides PFAS, FASN, AGPS ALDH1A1 472/4885TP53 3482/4885HIF1A 2831/4885

“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.