SCHEMBL16136105

SCHEMBL16136105

CCN(C(=O)c1nn(-c2ccc(C(F)(F)F)cc2)c(=O)c2c1c1ccccc1n2C)c1ccccc1

nearest known ligand 0.72

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.72
GAA P10253 1/20 0.72
MAPT P10636 8/20 0.69
SMN1; SMN2 Q16637 4/20 0.67
ALDH1A1 P00352 3/20 0.67
POLB P06746 3/20 0.57
TP53 P04637 5/20 0.55
TSHR P16473 4/20 0.52
KMT2A Q03164 3/20 0.52
HPGD P15428 2/20 0.52
MAPK1 P28482 1/20 0.52
RXFP1 Q9HBX9 2/20 0.50
HSD17B10 Q99714 3/20 0.49
ALOX15 P16050 1/20 0.49

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
SCHEMBL16136109 0.89 KDM4E (0.60) KDM4EGAAMAPTSMN1; SMN2ALDH1A1
SCHEMBL16136046 0.89 KDM4E (0.74) KDM4EGAAMAPTSMN1; SMN2ALDH1A1
SCHEMBL16311057 0.89 KDM4E (0.77) KDM4EGAAMAPTSMN1; SMN2ALDH1A1
SCHEMBL16136101 0.88 KDM4E (0.75) KDM4EGAAMAPTSMN1; SMN2ALDH1A1
SCHEMBL16135907 0.87 KDM4E (0.74) KDM4EGAAMAPTSMN1; SMN2ALDH1A1
SCHEMBL16136103 0.86 KDM4E (0.95) KDM4EGAAMAPTSMN1; SMN2ALDH1A1
SCHEMBL16136161 0.84 KDM4E (0.69) KDM4EGAAMAPTSMN1; SMN2ALDH1A1
SCHEMBL16136184 0.84 KDM4E (0.67) KDM4EGAAMAPTSMN1; SMN2ALDH1A1
SCHEMBL16136045 0.84 KDM4E (0.66) KDM4EGAAMAPTSMN1; SMN2ALDH1A1
SCHEMBL16136047 0.83 KDM4E (0.68) KDM4EGAAMAPTSMN1; SMN2ALDH1A1

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 12 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-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-20180093976-A1 PYRIDAZINONE COMPOUNDS AND METHODS FOR THE TREATMENT OF CYSTIC FIBROSIS FLATLEY DISCOVERY LAB LLC (US) 2018-04-05 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-9783529-B2 Pyridazinone compounds and methods for the treatment of cystic fibrosis FLATLEY DISCOVERY LAB, LLC (US) 2017-10-10 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
US-20150005300-A1 PYRIDAZINONE COMPOUNDS AND METHODS FOR THE TREATMENT OF CYSTIC FIBROSIS FLATLEY DISCOVERY LAB (US) 2015-01-01 US disclosed
US-20150005300-A1 PYRIDAZINONE COMPOUNDS AND METHODS FOR THE TREATMENT OF CYSTIC FIBROSIS FLATLEY DISCOVERY LAB (US) 2015-01-01 US disclosed
WO-2014160440-A1 PYRIDAZINONE COMPOUNDS AND METHODS FOR THE TREATMENT OF CYSTIC FIBROSIS FLATLEY DISCOVERY LAB (US) 2014-10-02 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 (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 771/4885MAPT 4861/4885
US-20180093976-A1 PYRIDAZINONE COMPOUNDS AND METHODS FOR THE TREATMENT OF CYSTIC FIBROSIS CFTR, SLC26A4, PNPO KDM4E 3610/4885GAA 771/4885MAPT 4861/4885
US-10370366-B2 Pyridazinone compounds and methods for the treatment of cystic fibrosis CFTR, SLC26A4, PNPO KDM4E 3610/4885GAA 771/4885MAPT 4861/4885

“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.