SCHEMBL128656

SCHEMBL128656

[CH2]Cc1cccnc1OCC

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SLC13A5 Q86YT5 2/20 0.47
L3MBTL1 Q9Y468 2/20 0.44
LMNA P02545 3/20 0.43
SMN1; SMN2 Q16637 3/20 0.42
HPGD P15428 1/20 0.42
MAPK1 P28482 1/20 0.41
ALDH1A1 P00352 4/20 0.40
TSHR P16473 2/20 0.40
NPC1 O15118 2/20 0.40
MAPT P10636 1/20 0.40
HTT P42858 1/20 0.40
POLB P06746 1/20 0.40
SLC6A2 P23975 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 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
SCHEMBL128485 0.85 HAO1 (0.40) SLC13A5L3MBTL1LMNASMN1; SMN2HPGD
SCHEMBL12948866 0.84 SLC13A5 (0.52) SLC13A5L3MBTL1LMNASMN1; SMN2HPGD
SCHEMBL129593 0.82 KDM1A (0.46) SLC13A5L3MBTL1MEN1KMT2A
SCHEMBL3418880 0.81 KMT2A (0.58) SLC13A5L3MBTL1LMNASMN1; SMN2HPGD
SCHEMBL21847112 0.81 SLC13A5 (0.47) SLC13A5L3MBTL1LMNASMN1; SMN2HPGD
SCHEMBL25070405 0.81 SLC13A5 (0.54) SLC13A5L3MBTL1LMNASMN1; SMN2HPGD
SCHEMBL2600005 0.81 SLC13A5 (0.47) SLC13A5L3MBTL1LMNASMN1; SMN2HPGD
SCHEMBL9534953 0.81 SLC13A5 (0.50) SLC13A5L3MBTL1LMNASMN1; SMN2HPGD
SCHEMBL24685762 0.81 SLC13A5 (0.50) SLC13A5L3MBTL1LMNASMN1; SMN2HPGD
SCHEMBL17084180 0.78 SLC13A5 (0.45) SLC13A5L3MBTL1LMNASMN1; SMN2HPGD

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
US-8450319-B2 Pyrrolopyridazinone compound UBE INDUSTRIES, LTD. (JP) 2013-05-28 US disclosed
EP-1982986-B1 PYRROLOPYRIDAZINONE COMPOUND AS PDE4 INHIBITOR UBE INDUSTRIES (JP) 2012-03-07 EP disclosed
CN-101374844-A Pyrrolopyridazinone compound UBE INDUSTRIES (JP) 2009-02-25 CN disclosed
US-20090036453-A1 Pyrrolopyridazinone Compound UBE INDUSTRIES, LTD. (JP) 2009-02-05 US disclosed
EP-1982986-A1 PYRROLOPYRIDAZINONE COMPOUND Ube Industries, Ltd. (JP) 2008-10-22 EP 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-20090036453-A1 Pyrrolopyridazinone Compound CBR3, CBR1, CYC1 SLC13A5 1728/4885L3MBTL1 2482/4885LMNA 1679/4885

“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.