SCHEMBL2301150

SCHEMBL2301150

O=C(c1ccc(-c2cc(Cl)c(CN3CC[C@@H](N4CCCCC4)C3=O)c(Cl)c2)cc1)N1CCC(C(F)(F)F)CC1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 2/20 0.41
L3MBTL3 Q96JM7 8/20 0.39
L3MBTL1 Q9Y468 7/20 0.39
MBTD1 Q05BQ5 6/20 0.39
LRRK2 Q5S007 1/20 0.39
KDM4E B2RXH2 1/20 0.39
MEN1 O00255 1/20 0.39
ALDH1A1 P00352 1/20 0.39
KMT2A Q03164 1/20 0.39
ALK Q9UM73 1/20 0.39
TP53BP1 Q12888 1/20 0.38
L3MBTL4 Q8NA19 1/20 0.38
MGLL Q99685 3/20 0.36
TNKS O95271 1/20 0.36
TNKS2 Q9H2K2 1/20 0.36

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
SCHEMBL2299298 1.00 NAMPT (0.41) NAMPTL3MBTL3L3MBTL1MBTD1LRRK2
SCHEMBL2296894 1.00 NAMPT (0.41) NAMPTL3MBTL3L3MBTL1MBTD1LRRK2
SCHEMBL2301303 0.93 NAMPT (0.41) NAMPTMGLLTNKSTNKS2
SCHEMBL2302392 0.93 NAMPT (0.41) NAMPTMGLLTNKSTNKS2
SCHEMBL2299295 0.91 NAMPT (0.39) NAMPTALKMGLLTNKSTNKS2
SCHEMBL12426044 0.91 NAMPT (0.39) NAMPTALKMGLLTNKSTNKS2
SCHEMBL13513555 0.88 L3MBTL3 (0.39) L3MBTL3L3MBTL1MBTD1LRRK2KDM4E
SCHEMBL13513567 0.88 NAMPT (0.38) NAMPTLRRK2ALKMGLLTNKS
SCHEMBL2296932 0.86 SPR (0.37) NAMPTL3MBTL3MBTD1ALDH1A1KMT2A
SCHEMBL2297696 0.83 TNKS (0.41) TNKSTNKS2

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-7994176-B2 Inhibitors of 11-beta-hydroxysteroid dehydrogenase 1 ELI LILLY AND COMPANY (US) 2011-08-09 US claimed
EP-2021337-B1 INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE 1 LILLY CO ELI (US) 2010-01-13 EP claimed
US-20090099182-A1 INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE 1 ELI LILLY AND COMPANY 2009-04-16 US claimed

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-20090099182-A1 INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE 1 HSD11B1, HSD11B2, HSD3B1 NAMPT 1816/4885L3MBTL3 4755/4885L3MBTL1 3444/4885

“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.