SCHEMBL20113799

SCHEMBL20113799

COc1cccc(-c2ccc(=O)n(C(C)C(=O)Nc3cccc(C#N)c3)n2)c1

nearest known ligand 0.62

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 9/20 0.62
TP53 P04637 3/20 0.51
FYN P06241 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
MCHR1 Q99705 1/20 0.46
LMNA P02545 4/20 0.46
KDM4E B2RXH2 1/20 0.46
POLB P06746 5/20 0.46
THRB P10828 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
FPR1 P21462 1/20 0.44
ABCG2 Q9UNQ0 1/20 0.44

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
SCHEMBL20113804 0.93 TP53 (0.56) MAPTTP53LMNAKDM4EPOLB
SCHEMBL20114212 0.91 MAPT (0.61) MAPTTP53FYNL3MBTL1LMNA
SCHEMBL20113789 0.88 TP53 (0.64) MAPTTP53FYNL3MBTL1LMNA
SCHEMBL31703244 0.88 MAPT (0.65) MAPTTP53LMNAPOLBTHRB
SCHEMBL20113788 0.87 POLB (0.56) MAPTTP53FYNL3MBTL1LMNA
SCHEMBL20113783 0.85 MAPT (0.54) MAPTTP53FYNL3MBTL1LMNA
SCHEMBL20114214 0.84 MAPT (0.54) MAPTTP53FYNL3MBTL1LMNA
SCHEMBL20113809 0.84 MAPT (0.58) MAPTTP53FYNL3MBTL1LMNA
SCHEMBL20120161 0.84 MAPT (0.53) MAPTTP53FYNLMNAPOLB
SCHEMBL20113802 0.84 POLB (0.55) MAPTTP53L3MBTL1LMNAPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190256474-A1 N-PHENYL-2-(3-PHENYL-6-OXO-1,6-DIHYDROPYRIDAZIN-1-YL)ACETAMIDE DERIVATIVES FOR TREATING CYSTIC FIBROSIS PROTEOSTASIS THERAPEUTICS, INC. 2019-08-22 US disclosed
US-20190256474-A1 N-PHENYL-2-(3-PHENYL-6-OXO-1,6-DIHYDROPYRIDAZIN-1-YL)ACETAMIDE DERIVATIVES FOR TREATING CYSTIC FIBROSIS PROTEOSTASIS THERAPEUTICS, INC. 2019-08-22 US disclosed
WO-2018081377-A1 N-PHENYL-2-(3-PHENYL-6-OXO-1,6-DIHYDROPYRIDAZIN-1-YL)ACETAMIDE DERIVATIVES FOR TREATING CYSTIC FIBROSIS PROTEOSTASIS THERAPEUTICS, INC. (US) 2018-05-03 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-20190256474-A1 N-PHENYL-2-(3-PHENYL-6-OXO-1,6-DIHYDROPYRIDAZIN-1-YL)ACETAMIDE DERIVATIVES FOR TREATING CYSTIC FIBROSIS CFTR, PKD2, CLCN2 MAPT 4874/4885TP53 2421/4885FYN 4531/4885

“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.