SCHEMBL134484

SCHEMBL134484

[CH2]Cc1cccc(C(=O)O)n1

nearest known ligand 0.61

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.61
ALOX15 P16050 1/20 0.61
TSHR P16473 1/20 0.61
ACMSD Q8TDX5 1/20 0.61
TDP1 Q9NUW8 1/20 0.61
MRGPRX4 Q96LA9 5/20 0.51
LMNA P02545 2/20 0.44
BRD4 O60885 1/20 0.44
GNE Q9Y223 1/20 0.43
PTGER1 P34995 2/20 0.42
KMT2A Q03164 1/20 0.42
MGAM O43451 1/20 0.41
NAPRT Q6XQN6 1/20 0.41
P4HTM Q9NXG6 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41

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
SCHEMBL2352264 0.83 KDM4E (0.67) KDM4EALOX15TSHRACMSDTDP1
SCHEMBL31591148 0.83 KDM4E (0.67) KDM4EALOX15TSHRACMSDTDP1
SCHEMBL28890736 0.82 NPSR1 (0.43) KDM4EALOX15TSHRACMSDTDP1
SCHEMBL7662023 0.82 KDM4E (0.64) KDM4EALOX15TSHRACMSDTDP1
SCHEMBL347912 0.82 KDM4E (0.64) KDM4EALOX15TSHRACMSDTDP1
SCHEMBL2348706 0.80 KDM4E (0.61) KDM4EALOX15TSHRACMSDTDP1
SCHEMBL31443034 0.80 KDM4E (0.61) KDM4EALOX15TSHRACMSDTDP1
SCHEMBL39745 0.80 KDM4E (0.61) KDM4EALOX15TSHRACMSDTDP1
SCHEMBL2881249 0.80 KDM4E (0.61) KDM4EALOX15TSHRACMSDTDP1
SCHEMBL31645967 0.80 KDM4E (0.61) KDM4EALOX15TSHRACMSDTDP1

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 KDM4E 1902/4885ALOX15 81/4885TSHR 1420/4885

“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.