SCHEMBL128147

SCHEMBL128147

[CH2]c1ccc(C(C)(C)O)s1

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.33
TSHR P16473 1/20 0.33
MAPK1 P28482 1/20 0.32
KMT2A Q03164 1/20 0.32
YEATS4 O95619 1/20 0.31
ALDH1A1 P00352 1/20 0.31

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
SCHEMBL1522583 0.80 MAPK1 (0.38) LMNATSHRMAPK1KMT2AYEATS4
SCHEMBL12264366 0.75 MAPK1 (0.47) LMNATSHRMAPK1KMT2AYEATS4
SCHEMBL128137 0.74 MLYCD (0.38)
SCHEMBL132097 0.74 TSHR (0.37) LMNATSHRMAPK1KMT2AYEATS4
SCHEMBL128148 0.73 MAPT (0.38) LMNATSHRMAPK1KMT2AYEATS4
SCHEMBL1164060 0.71 CES2 (0.38) LMNATSHRMAPK1KMT2AYEATS4
SCHEMBL129043 0.70 DAO (0.45)
SCHEMBL15220425 0.68 ALDH1A1 (0.40) LMNATSHRMAPK1KMT2AALDH1A1
SCHEMBL16021741 0.68 LMNA (0.31) LMNATSHRMAPK1KMT2A
SCHEMBL6616038 0.67 CYP2E1 (0.38)

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 LMNA 1679/4885TSHR 1420/4885MAPK1 3503/4885

“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.