SCHEMBL3123162

SCHEMBL3123162

CCOC(=O)c1cc(-c2cc(C(=O)OC)c(C)o2)cc(CBr)n1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.41
KDM4E B2RXH2 3/20 0.41
HTT P42858 1/20 0.41
SMN1; SMN2 Q16637 3/20 0.37
HPGD P15428 4/20 0.36
TSHR P16473 2/20 0.36
NPSR1 Q6W5P4 1/20 0.35
CYP1A2 P05177 1/20 0.35
BRCA1 P38398 1/20 0.35
TARBP2 Q15633 3/20 0.35
FUCA1 P04066 3/20 0.35
PPARG P37231 1/20 0.35
NCOA2 Q15596 1/20 0.35
GLB1 P16278 1/20 0.35
USP2 O75604 1/20 0.35
LMNA P02545 1/20 0.35
PDCD4 Q53EL6 1/20 0.34
MAOB P27338 2/20 0.34
ALOX15 P16050 1/20 0.34
NPC1 O15118 1/20 0.34

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
SCHEMBL3016094 0.90 ALDH1A1 (0.41) ALDH1A1KDM4EHTTSMN1; SMN2HPGD
SCHEMBL3021173 0.85 ALDH1A1 (0.38) ALDH1A1KDM4EHTTHPGDTSHR
SCHEMBL3016916 0.81 CYP1A2 (0.36) ALDH1A1KDM4EHTTSMN1; SMN2HPGD
SCHEMBL13132170 0.80 CYP1A2 (0.40) ALDH1A1KDM4ESMN1; SMN2HPGDCYP1A2
SCHEMBL3004679 0.78 ALDH1A1 (0.35) ALDH1A1KDM4EHTTSMN1; SMN2HPGD
SCHEMBL3477651 0.78 ALDH1A1 (0.48) ALDH1A1KDM4EHTTSMN1; SMN2HPGD
SCHEMBL2108554 0.76 L3MBTL1 (0.51) ALDH1A1KDM4ESMN1; SMN2HPGDTSHR
SCHEMBL3019716 0.75 MAPT (0.39) ALDH1A1KDM4EHTTSMN1; SMN2HPGD
SCHEMBL862383 0.72 CYP1A2 (0.49) ALDH1A1KDM4ESMN1; SMN2HPGDTSHR
SCHEMBL842355 0.71 DPP4 (0.42) ALDH1A1KDM4EHTTHPGDTSHR

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 5 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
EP-2195310-A1 LUMINESCENT LANTHANIDE (III) CHELATES, CHELATING AGENTS AND CONJUGATES DERIVED THEREOF Wallac OY (FI) 2010-06-16 EP disclosed
WO-2009030819-A1 LUMINESCENT LANTHANIDE (III) CHELATES, CHELATING AGENTS AND CONJUGATES DERIVED THEREOF WALLAC OY (FI) 2009-03-12 WO 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 ALDH1A1 4545/4885KDM4E 2737/4885HTT 1969/4885

“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.