SCHEMBL10197826

SCHEMBL10197826

O=c1ccc(-c2ccc(OCCCN3CCOCC3)cc2)c[nH]1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 12/20 0.66
HRH2 P25021 1/20 0.62
HRH1 P35367 1/20 0.62
PRKAB2 O43741 1/20 0.61
LCK P06239 1/20 0.61
SRC P12931 1/20 0.61
FLT1 P17948 1/20 0.61
EPHA2 P29317 1/20 0.61
KDR P35968 1/20 0.61
PRKAG1 P54619 1/20 0.61
PRKAA2 P54646 1/20 0.61
PRKAA1 Q13131 1/20 0.61
RPS6KA1 Q15418 1/20 0.61
MKNK1 Q9BUB5 1/20 0.61
PRKAG3 Q9UGI9 1/20 0.61
PRKAG2 Q9UGJ0 1/20 0.61
PRKAB1 Q9Y478 1/20 0.61
MAPK1 P28482 2/20 0.59
ALDH1A1 P00352 1/20 0.59
CYP1A2 P05177 1/20 0.59

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
SCHEMBL4090612 0.80 HRH3 (0.82) HRH3HRH2HRH1MAPK1ALDH1A1
SCHEMBL11899308 0.80 RAB9A (0.83) HRH3HRH2HRH1MAPK1ALDH1A1
SCHEMBL1374209 0.80 HRH3 (1.00) HRH3HRH2HRH1MAPK1ALDH1A1
SCHEMBL27914448 0.79 HRH3 (0.76) HRH3HRH2HRH1MAPK1ALDH1A1
SCHEMBL14724514 0.79 HRH3 (0.71) HRH3HRH2HRH1MAPK1ALDH1A1
SCHEMBL3141155 0.78 HRH3 (0.73) HRH3HRH2HRH1MAPK1ALDH1A1
SCHEMBL14714478 0.77 HRH3 (0.77) HRH3HRH2HRH1MAPK1ALDH1A1
SCHEMBL14714916 0.76 HRH3 (1.00) HRH3HRH2HRH1MAPK1ALDH1A1
SCHEMBL27896953 0.76 HRH3 (0.76) HRH3HRH2HRH1MAPK1ALDH1A1
Pramoxine SCHEMBL26020 0.75 ALDH1A1 (1.00) HRH3HRH2HRH1MAPK1ALDH1A1

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-8207168-B2 Pyridazinone derivatives CEPHALON, INC. (US) 2012-06-26 US disclosed
US-8207168-B2 Pyridazinone derivatives CEPHALON, INC. (US) 2012-06-26 US disclosed
US-20100280007-A1 Pyridazinone Derivatives CEPHALON, INC. (US) 2010-11-04 US disclosed
US-20100280007-A1 Pyridazinone Derivatives CEPHALON, INC. (US) 2010-11-04 US 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-20100280007-A1 Pyridazinone Derivatives HRH3, HNMT, HRH4 HRH3 1/4885HRH2 7/4885HRH1 5/4885

“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.