SCHEMBL6440859

SCHEMBL6440859

[NH]C(=N)NC1CCCCC1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 5/20 0.52
SMN1; SMN2 Q16637 4/20 0.52
ALDH1A1 P00352 3/20 0.52
NPC1 O15118 3/20 0.52
RAB9A P51151 3/20 0.52
CYP3A4 P08684 2/20 0.52
TP53 P04637 1/20 0.52
MAPT P10636 1/20 0.52
KDM4E B2RXH2 1/20 0.52
EPHX2 P34913 1/20 0.52
SIGMAR1 Q99720 3/20 0.46
LMNA P02545 1/20 0.44
GAA P10253 1/20 0.44
MMP2 P08253 3/20 0.43
CA12 O43570 2/20 0.43
CA1 P00915 2/20 0.43
CA2 P00918 2/20 0.43
CA9 Q16790 2/20 0.43
MMP8 P22894 1/20 0.43
HSD17B10 Q99714 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
SCHEMBL2740861 0.80 EPHX1 (0.55) EPHX1SMN1; SMN2ALDH1A1NPC1RAB9A
SCHEMBL3915783 0.77 EPHX1 (0.50) EPHX1SMN1; SMN2ALDH1A1NPC1RAB9A
SCHEMBL2233593 0.76 EPHX1 (0.50) EPHX1SMN1; SMN2ALDH1A1NPC1RAB9A
SCHEMBL8345551 0.76 EPHX1 (0.50) EPHX1SMN1; SMN2ALDH1A1NPC1RAB9A
SCHEMBL1854094 0.76 ALDH1A1 (0.64) EPHX1SMN1; SMN2ALDH1A1NPC1RAB9A
SCHEMBL23736061 0.76 EPHX1 (0.50) EPHX1SMN1; SMN2ALDH1A1NPC1RAB9A
SCHEMBL530140 0.76 EPHX1 (0.64) EPHX1SMN1; SMN2ALDH1A1NPC1RAB9A
SCHEMBL19359635 0.76 EPHX1 (0.50) EPHX1SMN1; SMN2ALDH1A1NPC1RAB9A
SCHEMBL19359634 0.76 EPHX1 (0.50) EPHX1SMN1; SMN2ALDH1A1NPC1RAB9A
SCHEMBL3070836 0.76 EPHX1 (0.50) EPHX1SMN1; SMN2ALDH1A1NPC1RAB9A

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-6936622-B2 6-phenylbenzonaphthyridines ALTANA PHARMA AG (DE) 2005-08-30 US claimed
EP-1377574-B1 6-PHENYLBENZONAPHTHYRIDINES BYK GULDEN LOMBERG CHEM FAB (DE) 2005-01-19 EP claimed
US-20040097537-A1 6-phenylbenzonaphthyridines TAKEDA GMBH (DE) 2004-05-20 US claimed
EP-1377574-A1 6-PHENYLBENZONAPHTHYRIDINES Byk Gulden Lomberg Chemische Fabrik GmbH (DE) 2004-01-07 EP claimed
WO-2002066476-A9 6-PHENYLBENZONAPHTHYRIDINES ALTANA PHARMA AG (DE) 2003-10-30 WO claimed
WO-2002066476-A1 6-PHENYLBENZONAPHTHYRIDINES ALTANA PHARMA AG (DE) 2002-08-29 WO claimed
US-6936622-B2 6-phenylbenzonaphthyridines ALTANA PHARMA AG (DE) 2005-08-30 US disclosed
EP-1377574-B1 6-PHENYLBENZONAPHTHYRIDINES BYK GULDEN LOMBERG CHEM FAB (DE) 2005-01-19 EP disclosed
US-20040097537-A1 6-phenylbenzonaphthyridines TAKEDA GMBH (DE) 2004-05-20 US disclosed
EP-1377574-A1 6-PHENYLBENZONAPHTHYRIDINES Byk Gulden Lomberg Chemische Fabrik GmbH (DE) 2004-01-07 EP disclosed
WO-2002066476-A9 6-PHENYLBENZONAPHTHYRIDINES ALTANA PHARMA AG (DE) 2003-10-30 WO disclosed
WO-2002066476-A1 6-PHENYLBENZONAPHTHYRIDINES ALTANA PHARMA AG (DE) 2002-08-29 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-20040097537-A1 6-phenylbenzonaphthyridines PDE3A, PDE4A, PDE3B EPHX1 2106/4885SMN1; SMN2 3290/4885ALDH1A1 879/4885

“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.