SCHEMBL4154352

SCHEMBL4154352

[CH2]c1ccccc1CCOCc1ccc(OC)cc1

nearest known ligand 0.55

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.55
TDP1 Q9NUW8 1/20 0.55
ABCB1 P08183 2/20 0.47
IDO1 P14902 2/20 0.42
AGXT P21549 2/20 0.42
LTA4H P09960 1/20 0.42
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
APP P05067 4/20 0.40
CHRM3 P20309 2/20 0.39
CALM1 P0DP23 1/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
BCHE P06276 1/20 0.39

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
SCHEMBL8338571 0.79 TDP1 (0.77) L3MBTL1TDP1ABCB1IDO1AGXT
SCHEMBL27615709 0.79 TDP1 (0.77) L3MBTL1TDP1ABCB1IDO1AGXT
SCHEMBL1268452 0.78 L3MBTL1 (0.51) L3MBTL1TDP1ABCB1IDO1AGXT
SCHEMBL1268455 0.78 L3MBTL1 (0.51) L3MBTL1TDP1ABCB1IDO1AGXT
SCHEMBL293291 0.77 L3MBTL1 (0.57) L3MBTL1TDP1ABCB1
SCHEMBL8499580 0.76 IDO1 (0.61) L3MBTL1TDP1IDO1AGXTLTA4H
SCHEMBL8716189 0.75 L3MBTL1 (0.70) L3MBTL1TDP1ABCB1LTA4HCHRM3
SCHEMBL1838338 0.73 TDP1 (0.54) L3MBTL1TDP1IDO1AGXTLTA4H
SCHEMBL19210361 0.73 L3MBTL1 (0.88) L3MBTL1TDP1ABCB1LTA4HCALM1
SCHEMBL4154354 0.73 TDP1 (0.55) L3MBTL1TDP1ABCB1IDO1AGXT

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-8461385-B2 Manufacture process of organic compounds NOVARTIS AG (CH) 2013-06-11 US disclosed
US-20090253811-A1 MANUFACTURE PROCESS OF ORGANIC COMPOUNDS NOVARTIS AG (CH) 2009-10-08 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-20090253811-A1 MANUFACTURE PROCESS OF ORGANIC COMPOUNDS NT5C, AADAC, DDC L3MBTL1 4426/4885TDP1 4191/4885ABCB1 1684/4885

“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.