SCHEMBL3019716

SCHEMBL3019716

CCOC(=O)c1cc(-c2oc(C)c(C(=O)OCC)c2C)cc(CBr)n1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.39
ALDH1A1 P00352 4/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
LMNA P02545 2/20 0.39
APAF1 O14727 1/20 0.39
MITF O75030 1/20 0.39
TSHR P16473 3/20 0.38
ALOX15 P16050 1/20 0.38
HSD17B10 Q99714 1/20 0.38
CYP1A2 P05177 2/20 0.37
GAA P10253 3/20 0.36
TDP2 O95551 2/20 0.36
HTT P42858 2/20 0.36
MAPK1 P28482 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
TARBP2 Q15633 2/20 0.36
NPC1 O15118 2/20 0.36
MEN1 O00255 1/20 0.36
CYP3A4 P08684 1/20 0.36

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
SCHEMBL3015657 0.89 MAPT (0.39) MAPTALDH1A1SMN1; SMN2LMNAAPAF1
SCHEMBL10317013 0.80 LMNA (0.37) MAPTALDH1A1SMN1; SMN2LMNATSHR
SCHEMBL3477651 0.75 ALDH1A1 (0.48) MAPTALDH1A1SMN1; SMN2TSHRALOX15
SCHEMBL3123162 0.75 ALDH1A1 (0.41) ALDH1A1SMN1; SMN2LMNATSHRALOX15
SCHEMBL13132170 0.74 CYP1A2 (0.40) MAPTALDH1A1SMN1; SMN2HSD17B10CYP1A2
SCHEMBL862383 0.74 CYP1A2 (0.49) MAPTALDH1A1SMN1; SMN2TSHRHSD17B10
SCHEMBL2108554 0.73 L3MBTL1 (0.51) MAPTALDH1A1SMN1; SMN2TSHRALOX15
SCHEMBL22854579 0.73 ALDH1A1 (0.50) MAPTALDH1A1SMN1; SMN2CYP1A2GAA
SCHEMBL3016916 0.71 CYP1A2 (0.36) MAPTALDH1A1SMN1; SMN2LMNATSHR
SCHEMBL3008215 0.71 ERN1 (0.48) MAPTALDH1A1SMN1; SMN2HSD17B10CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2195310-B1 LUMINESCENT LANTHANIDE (III) CHELATES, CHELATING AGENTS AND CONJUGATES DERIVED THEREOF WALLAC OY (FI) 2016-06-01 EP disclosed
US-8221719-B2 Luminescent lanthanide (III) chelates, chelating agents and conjugates derived thereof WALLAC OY (FI) 2012-07-17 US disclosed
US-20100204442-A1 Luminescent lanthanide (III) chelates, chelating agents and conjugates derived thereof WALLAC OY (FI) 2010-08-12 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-20100204442-A1 Luminescent lanthanide (III) chelates, chelating agents and conjugates derived thereof LNPEP, SLC39A3, LAP3 MAPT 2629/4885ALDH1A1 4545/4885SMN1; SMN2 3602/4885

“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.