SCHEMBL128773

SCHEMBL128773

CCOC(=O)c1c(Cc2cccc(OC)n2)cn(COCc2ccccc2)c1C=O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.37
TGFBR1 P36897 1/20 0.37
L3MBTL1 Q9Y468 2/20 0.36
TDP1 Q9NUW8 1/20 0.36
NPC1 O15118 2/20 0.36
RAB9A P51151 2/20 0.36
KMT2A Q03164 2/20 0.36
MAPK1 P28482 2/20 0.35
KDM4E B2RXH2 5/20 0.35
ALDH1A1 P00352 5/20 0.35
GAA P10253 4/20 0.35
HPGD P15428 3/20 0.35
CASP1 P29466 2/20 0.35
CASP7 P55210 2/20 0.35
HSD17B10 Q99714 2/20 0.35
TSHR P16473 1/20 0.35
MAPT P10636 4/20 0.34
CSNK1D P48730 1/20 0.34
LMNA P02545 4/20 0.33
PKM P14618 1/20 0.33

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
SCHEMBL128231 0.84 SMN1; SMN2 (0.39) SMN1; SMN2TGFBR1L3MBTL1TDP1NPC1
SCHEMBL131110 0.83 ALDH1A1 (0.37) SMN1; SMN2TGFBR1L3MBTL1TDP1NPC1
SCHEMBL127986 0.80 NPC1 (0.43) SMN1; SMN2L3MBTL1TDP1NPC1RAB9A
SCHEMBL129168 0.78 SMN1; SMN2 (0.39) SMN1; SMN2NPC1RAB9AKMT2AMAPK1
SCHEMBL128226 0.78 SMN1; SMN2 (0.39) SMN1; SMN2L3MBTL1TDP1NPC1RAB9A
SCHEMBL128523 0.77 SLC7A5 (0.41) SMN1; SMN2L3MBTL1TDP1NPC1RAB9A
SCHEMBL127787 0.76 KMT2A (0.44) SMN1; SMN2L3MBTL1TDP1NPC1RAB9A
SCHEMBL129380 0.71 UCHL1 (0.39) SMN1; SMN2NPC1RAB9AKMT2AMAPK1
SCHEMBL129377 0.71 MAPT (0.36) L3MBTL1KDM4EALDH1A1GAAHPGD
SCHEMBL128898 0.69 KMT2A (0.36) SMN1; SMN2L3MBTL1TDP1NPC1RAB9A

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 4 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
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 SMN1; SMN2 4613/4885TGFBR1 2268/4885L3MBTL1 2482/4885

“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.