SCHEMBL16336145

SCHEMBL16336145

CCN(C(=O)c1nn(CC(O)COC)c(=O)c2c1c1ccccc1n2C)c1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.60
GAA P10253 1/20 0.60
ALDH1A1 P00352 4/20 0.56
SMN1; SMN2 Q16637 3/20 0.56
MAPT P10636 9/20 0.48
POLB P06746 2/20 0.47
TP53 P04637 5/20 0.46
ATM Q13315 1/20 0.42
TSHR P16473 3/20 0.41
HSD17B10 Q99714 2/20 0.41
HPGD P15428 3/20 0.41
KMT2A Q03164 3/20 0.40
ALOX15 P16050 1/20 0.40
RXFP1 Q9HBX9 1/20 0.40
MAPK1 P28482 1/20 0.40
NPSR1 Q6W5P4 1/20 0.39

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
SCHEMBL16135941 1.00 KDM4E (0.60) KDM4EGAAALDH1A1SMN1; SMN2MAPT
SCHEMBL16135926 0.91 KDM4E (0.56) KDM4EGAAALDH1A1SMN1; SMN2MAPT
SCHEMBL16336169 0.91 KDM4E (0.55) KDM4EGAAALDH1A1SMN1; SMN2MAPT
SCHEMBL16336170 0.91 KDM4E (0.55) KDM4EGAAALDH1A1SMN1; SMN2MAPT
SCHEMBL16135958 0.90 KDM4E (0.58) KDM4EGAAALDH1A1SMN1; SMN2MAPT
SCHEMBL16336135 0.90 KDM4E (0.58) KDM4EGAAALDH1A1SMN1; SMN2MAPT
SCHEMBL16136008 0.88 KDM4E (0.65) KDM4EGAAALDH1A1SMN1; SMN2MAPT
SCHEMBL16111116 0.83 KDM4E (0.61) KDM4EGAAALDH1A1SMN1; SMN2MAPT
SCHEMBL16136205 0.82 KDM4E (0.61) KDM4EGAAALDH1A1SMN1; SMN2MAPT
SCHEMBL19442778 0.82 KDM4E (0.41) KDM4EGAAALDH1A1SMN1; SMN2MAPT

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-10370366-B2 Pyridazinone compounds and methods for the treatment of cystic fibrosis FLATLEY DISCOVERY LAB, LLC (US) 2019-08-06 US disclosed
US-20180093976-A1 PYRIDAZINONE COMPOUNDS AND METHODS FOR THE TREATMENT OF CYSTIC FIBROSIS FLATLEY DISCOVERY LAB LLC (US) 2018-04-05 US disclosed
US-9783529-B2 Pyridazinone compounds and methods for the treatment of cystic fibrosis FLATLEY DISCOVERY LAB, LLC (US) 2017-10-10 US disclosed
US-20150005300-A1 PYRIDAZINONE COMPOUNDS AND METHODS FOR THE TREATMENT OF CYSTIC FIBROSIS FLATLEY DISCOVERY LAB (US) 2015-01-01 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 (3 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-20150005300-A1 PYRIDAZINONE COMPOUNDS AND METHODS FOR THE TREATMENT OF CYSTIC FIBROSIS CFTR, SLC26A4, PNPO KDM4E 3610/4885GAA 771/4885ALDH1A1 1301/4885
US-20180093976-A1 PYRIDAZINONE COMPOUNDS AND METHODS FOR THE TREATMENT OF CYSTIC FIBROSIS CFTR, SLC26A4, PNPO KDM4E 3610/4885GAA 771/4885ALDH1A1 1301/4885
US-10370366-B2 Pyridazinone compounds and methods for the treatment of cystic fibrosis CFTR, SLC26A4, PNPO KDM4E 3610/4885GAA 771/4885ALDH1A1 1301/4885

“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.