SCHEMBL127883

SCHEMBL127883

C[Si](C)(C)CCOCn1ncc2c(c(C(O)c3ccc(F)cc3)cn2COCc2ccccc2)c1=O

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F2RL1 P55085 1/20 0.35
DGAT1 O75907 2/20 0.34
ALDH1A1 P00352 2/20 0.33
CYP1A2 P05177 2/20 0.33
CASP1 P29466 2/20 0.33
CASP7 P55210 2/20 0.33
HSD17B10 Q99714 2/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
ASAH1 Q13510 1/20 0.33
CYP3A4 P08684 1/20 0.31
CYP2C9 P11712 1/20 0.31
HPGD P15428 1/20 0.31
CYP2C19 P33261 1/20 0.31
SLC6A3 Q01959 1/20 0.30
EGFR P00533 1/20 0.30
IGF1R P08069 1/20 0.30
SRC P12931 1/20 0.30
FLT4 P35916 1/20 0.30
KDR P35968 1/20 0.30

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
SCHEMBL128992 0.91 DGAT1 (0.35) F2RL1DGAT1ASAH1EGFRIGF1R
SCHEMBL128762 0.85 DGAT1 (0.37) F2RL1DGAT1ALDH1A1HSD17B10EGFR
SCHEMBL129617 0.81 DGAT1 (0.40) DGAT1ALDH1A1HSD17B10HPGDEGFR
SCHEMBL129633 0.80 DGAT1 (0.39) DGAT1ALDH1A1HSD17B10HPGDEGFR
SCHEMBL129084 0.80 DGAT1 (0.38) DGAT1ALDH1A1HSD17B10EGFRIGF1R
SCHEMBL128689 0.79 UPP1 (0.41) DGAT1ALDH1A1HSD17B10EGFRIGF1R
SCHEMBL127546 0.79 DGAT1 (0.37) DGAT1ALDH1A1CYP1A2HSD17B10MEN1
SCHEMBL170283 0.77 DGAT1 (0.39) DGAT1ALDH1A1EGFRIGF1RSRC
SCHEMBL130167 0.75 F2RL1 (0.34) F2RL1DGAT1EGFRIGF1RSRC
SCHEMBL130077 0.75 F2RL1 (0.34) F2RL1DGAT1EGFRIGF1RSRC

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 F2RL1 2249/4885DGAT1 2027/4885ALDH1A1 580/4885

“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.