SCHEMBL14480641

SCHEMBL14480641

Nc1c2c(nc3ccccc13)CCN(CC(=O)Nc1cc(Cl)ccc1Cl)C2

nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 5/20 0.56
▸ MAPT P10636 4/20 0.56
▸ KDM4E B2RXH2 2/20 0.56
▸ KMT2A Q03164 5/20 0.55
▸ MEN1 O00255 3/20 0.55
▸ ALDH1A1 P00352 3/20 0.49
▸ NPSR1 Q6W5P4 2/20 0.49
▸ POLB P06746 4/20 0.47
▸ L3MBTL1 Q9Y468 3/20 0.47
▸ USP2 O75604 1/20 0.45
▸ TP53 P04637 1/20 0.44
▸ SMN1; SMN2 Q16637 1/20 0.42

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
SCHEMBL14481159 0.88 POLB (0.64) LMNAMAPTKMT2AMEN1ALDH1A1
SCHEMBL2319410 0.82 LMNA (0.47) LMNAMAPTKDM4EKMT2AMEN1
SCHEMBL12299750 0.80 POLB (0.65) LMNAMAPTALDH1A1POLBL3MBTL1
SCHEMBL3348041 0.79 POLB (0.63) LMNAMAPTKDM4EALDH1A1NPSR1
SCHEMBL14481013 0.77 POLB (0.60) LMNAMAPTKMT2AMEN1ALDH1A1
SCHEMBL3347940 0.76 MAPT (0.48) LMNAMAPTKDM4EKMT2AMEN1
SCHEMBL2421390 0.76 POLB (0.59) LMNAMAPTALDH1A1POLBL3MBTL1
SCHEMBL2321536 0.76 MAPT (0.48) LMNAMAPTKDM4EKMT2AALDH1A1
SCHEMBL14480889 0.75 POLB (0.58) LMNAMAPTALDH1A1POLBL3MBTL1
SCHEMBL2316929 0.75 ALDH1A1 (0.46) LMNAMAPTKDM4EKMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2552914-B1 BENZONAPHTHYRIDINAMINES AS AUTOTAXIN INHIBITORS MERCK PATENT GMBH (DE) 2015-11-11 — — EP claimed
US-9029387-B2 Benzonaphthyridinamines as autotaxin inhibitors MERCK PATENT GMBH (DE) 2015-05-12 — — US claimed
US-20130012505-A1 BENZONAPHTHYRIDINAMINES AS AUTOTAXIN INHIBITORS MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2013-01-10 — — US claimed
EP-2552914-B1 BENZONAPHTHYRIDINAMINES AS AUTOTAXIN INHIBITORS MERCK PATENT GMBH (DE) 2015-11-11 — — EP disclosed
US-9029387-B2 Benzonaphthyridinamines as autotaxin inhibitors MERCK PATENT GMBH (DE) 2015-05-12 — — US disclosed
US-9029387-B2 Benzonaphthyridinamines as autotaxin inhibitors MERCK PATENT GMBH (DE) 2015-05-12 — — US disclosed
US-9029387-B2 Benzonaphthyridinamines as autotaxin inhibitors MERCK PATENT GMBH (DE) 2015-05-12 — — US disclosed
US-20130012505-A1 BENZONAPHTHYRIDINAMINES AS AUTOTAXIN INHIBITORS MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2013-01-10 — — US disclosed
US-20130012505-A1 BENZONAPHTHYRIDINAMINES AS AUTOTAXIN INHIBITORS MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2013-01-10 — — US disclosed
US-20130012505-A1 BENZONAPHTHYRIDINAMINES AS AUTOTAXIN INHIBITORS MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2013-01-10 — — 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-20130012505-A1 BENZONAPHTHYRIDINAMINES AS AUTOTAXIN INHIBITORS ENPP2, LYPLAL1, LYPLA1 LMNA 990/4885MAPT 3567/4885KDM4E 1421/4885

“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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