SCHEMBL1820114

SCHEMBL1820114

CN(F)CC(=O)N(C)c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 4/20 0.51
▸ POLQ O75417 3/20 0.51
▸ MEN1 O00255 1/20 0.46
▸ GAA P10253 1/20 0.46
▸ HPGD P15428 1/20 0.46
▸ CYP3A4 P08684 1/20 0.44
▸ CYP2C9 P11712 1/20 0.44
▸ CYP2C19 P33261 1/20 0.44
▸ NPSR1 Q6W5P4 1/20 0.44
▸ CHRNB2 P17787 1/20 0.44
▸ CHRNB4 P30926 1/20 0.44
▸ CHRNA3 P32297 1/20 0.44
▸ CHRNA4 P43681 1/20 0.44
▸ KDM4E B2RXH2 2/20 0.43
▸ ALDH1A1 P00352 1/20 0.43
▸ POLB P06746 1/20 0.43

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
SCHEMBL1819075 0.84 KMT2A (0.54) KMT2APOLQMEN1CYP3A4CYP2C9
SCHEMBL11675144 0.82 KMT2A (0.53) KMT2APOLQMEN1CYP3A4CYP2C9
SCHEMBL1819056 0.81 KMT2A (0.51) KMT2APOLQMEN1CYP3A4CYP2C9
SCHEMBL1822225 0.80 KMT2A (0.54) KMT2APOLQMEN1CYP3A4CYP2C9
SCHEMBL1760632 0.79 KMT2A (0.58) KMT2APOLQMEN1CYP3A4CYP2C9
SCHEMBL9887 0.78 KMT2A (0.56) KMT2APOLQMEN1CYP3A4CYP2C9
SCHEMBL5601309 0.78 KMT2A (0.56) KMT2APOLQMEN1CYP3A4CYP2C9
SCHEMBL7830345 0.78 KMT2A (0.56) KMT2APOLQMEN1CYP3A4CYP2C9
SCHEMBL1818383 0.77 PPIB (0.52) KMT2APOLQMEN1GAACYP3A4
SCHEMBL1823609 0.77 ATM (0.49) KMT2APOLQMEN1KDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7947712-B2 Antiarthritic agents; asthma; chronic obstructive pulminary diosrders; atherosclerosis; vision defects; hepatitis; central nervous system disorders; cardiovascular disorders; wound healing agents; restenosis; cirrhosis; multiple sclerosis; glomerulonephritis; graft versus host disease; antidiabetic agent WYETH LLC (US) 2011-05-24 — — US disclosed
US-20080269213-A1 8-Hydroxyquinoline compounds and methods thereof WYETH (US) 2008-10-30 — — 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-20080269213-A1 8-Hydroxyquinoline compounds and methods thereof MMP8, MMP26, MMP9 KMT2A 4052/4885POLQ 104/4885MEN1 2254/4885

“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.

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