SCHEMBL13893262

SCHEMBL13893262

O=C(CCl)N1CCOCCOCCOCCOCC1

nearest known ligand 0.57

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.57
SMN1; SMN2 Q16637 3/20 0.52
TSHR P16473 3/20 0.52
ALOX15 P16050 1/20 0.52
HSD17B10 Q99714 1/20 0.52
ALDH1A1 P00352 3/20 0.50
POLB P06746 3/20 0.47
GAA P10253 1/20 0.47
HTT P42858 2/20 0.47
CA12 O43570 1/20 0.46
CA1 P00915 1/20 0.46
CA9 Q16790 1/20 0.46
RAB9A P51151 1/20 0.46
KMT2A Q03164 1/20 0.46
GLA P06280 1/20 0.46
LMNA P02545 1/20 0.46

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
SCHEMBL31677054 1.00 L3MBTL1 (0.57) L3MBTL1SMN1; SMN2TSHRALOX15HSD17B10
SCHEMBL20547280 0.98 L3MBTL1 (0.59) L3MBTL1SMN1; SMN2TSHRALOX15HSD17B10
SCHEMBL78389 0.98 L3MBTL1 (0.59) L3MBTL1SMN1; SMN2TSHRALOX15HSD17B10
SCHEMBL18011765 0.98 L3MBTL1 (0.59) L3MBTL1SMN1; SMN2TSHRALOX15HSD17B10
Hydrochloric Acid SCHEMBL8118571 0.95 L3MBTL1 (0.57) L3MBTL1SMN1; SMN2TSHRALOX15HSD17B10
SCHEMBL773501 0.90 L3MBTL1 (0.52) L3MBTL1SMN1; SMN2TSHRALOX15HSD17B10
SCHEMBL11742016 0.90 L3MBTL1 (0.52) L3MBTL1SMN1; SMN2TSHRALOX15HSD17B10
Propionic Acid SCHEMBL23466968 0.86 ALDH1A1 (0.49) L3MBTL1SMN1; SMN2TSHRALOX15HSD17B10
SCHEMBL22196916 0.85 ALOX15 (0.72) L3MBTL1SMN1; SMN2TSHRALOX15HSD17B10
SCHEMBL18633170 0.84

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-20090104124-A1 Paramagnetic Complexes with Pendant Crown Compounds Showing Improved Targeting- Specificity as MRI Contrast Agents UNIVERSITY HONG KONG, THE (CN) 2009-04-23 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-20090104124-A1 Paramagnetic Complexes with Pendant Crown Compounds Showing Improved Targeting- Specificity as MRI Contrast Agents ABCB11, ATP6V1B1, SLC5A7 L3MBTL1 656/4885SMN1; SMN2 1076/4885TSHR 2067/4885

“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.