SCHEMBL10276563

SCHEMBL10276563

Cn1ncc(NCC(=O)O)cc1=O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 1/20 0.40
FABP4 P15090 2/20 0.35
CNR2 P34972 1/20 0.35
ALDH1A1 P00352 4/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
HTT P42858 2/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
THRA P10827 1/20 0.33
THRB P10828 1/20 0.33
BRD4 O60885 2/20 0.33
BRD9 Q9H8M2 2/20 0.33
LMNA P02545 2/20 0.33
HPGD P15428 2/20 0.33
MAPK1 P28482 1/20 0.33
BPTF Q12830 1/20 0.33
ADORA3 P0DMS8 1/20 0.32
ADORA1 P30542 1/20 0.32
KDM4C Q9H3R0 1/20 0.32
KAT2B Q92831 1/20 0.32
GRIN2D O15399 1/20 0.32

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
Hydrochloric Acid SCHEMBL5641612 0.77 CNR2 (0.40) PTGS1CNR2ALDH1A1SMN1; SMN2HTT
SCHEMBL26790023 0.75 ALDH1A1 (0.51) ALDH1A1SMN1; SMN2HTTL3MBTL1HPGD
SCHEMBL3249821 0.75 CNR2 (0.41) PTGS1CNR2ALDH1A1SMN1; SMN2HTT
Hydrochloric Acid SCHEMBL3254331 0.75 CNR2 (0.39) PTGS1CNR2ALDH1A1SMN1; SMN2HTT
SCHEMBL10276811 0.71 SMN1; SMN2 (0.42) PTGS1SMN1; SMN2L3MBTL1LMNAHPGD
SCHEMBL186256 0.68 PTGS1 (0.49) PTGS1ALDH1A1L3MBTL1LMNAHPGD
SCHEMBL1229534 0.67 ITGA4 (0.43) BPTF
SCHEMBL27517964 0.67 PTGS1 (0.35) PTGS1CNR2BRD4BRD9BPTF
SCHEMBL13603829 0.65 KDM4E (0.49) FABP4SMN1; SMN2MAPK1KDM4E
SCHEMBL31042153 0.65 PTGS1 (0.39) PTGS1ALDH1A1BRD4BRD9KAT2B

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2462121-B1 DERIVATIVES OF 2H PYRIDAZIN-3-ONES, THEIR PREPARATION AND THEIR USE AS SCD-1 INHIBITORS PF MEDICAMENT (FR) 2015-02-18 EP disclosed
EP-2462121-B1 DERIVATIVES OF 2H PYRIDAZIN-3-ONES, THEIR PREPARATION AND THEIR USE AS SCD-1 INHIBITORS PF MEDICAMENT (FR) 2015-02-18 EP disclosed
US-8946225-B2 Derivatives of 2H pyridazin-3-ones, their preparation and their use as SCD-1 inhibitors PIERRE FABRE MEDICAMENT (FR) 2015-02-03 US disclosed
US-8946225-B2 Derivatives of 2H pyridazin-3-ones, their preparation and their use as SCD-1 inhibitors PIERRE FABRE MEDICAMENT (FR) 2015-02-03 US disclosed
US-20120178678-A1 DERIVATIVES OF 2H PYRIDAZIN- 3 -ONES, THEIR PREPARATION AND THEIR USE AS SCD-1 INHIBITORS PIERRE FABRE MEDICAMENT (FR) 2012-07-12 US disclosed
US-20120178678-A1 DERIVATIVES OF 2H PYRIDAZIN- 3 -ONES, THEIR PREPARATION AND THEIR USE AS SCD-1 INHIBITORS PIERRE FABRE MEDICAMENT (FR) 2012-07-12 US disclosed
WO-2011015629-A1 DERIVATIVES OF 2H PYRIDAZIN- 3 -ONES, THEIR PREPARATION AND THEIR USE AS SCD-1 INHIBITORS PIERRE FABRE MEDICAMENT (FR) 2011-02-10 WO 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-20120178678-A1 DERIVATIVES OF 2H PYRIDAZIN- 3 -ONES, THEIR PREPARATION AND THEIR USE AS SCD-1 INHIBITORS SCD, SCD5, CYP2S1 PTGS1 342/4885FABP4 86/4885CNR2 477/4885

“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.