SCHEMBL4570093

SCHEMBL4570093

[C-]#[N+]c1nccnc1N1CCCC2(CCN(c3ccccc3C)C2=O)C1

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
EGLN1 Q9GZT9 14/20 0.38
MALT1 Q9UDY8 1/20 0.36
DDB1 Q16531 1/20 0.33
CRBN Q96SW2 1/20 0.33
HCRTR2 O43614 2/20 0.33
AR P10275 1/20 0.33
HCRTR1 O43613 1/20 0.32

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
SCHEMBL17081994 0.85 MALT1 (0.41) EGLN1MALT1DDB1CRBNHCRTR2
SCHEMBL549480 0.85 MALT1 (0.41) EGLN1MALT1DDB1CRBNHCRTR2
SCHEMBL17081990 0.82 EGLN1 (0.40) EGLN1MALT1DDB1CRBNHCRTR2
SCHEMBL550677 0.82 EGLN1 (0.40) EGLN1MALT1DDB1CRBNHCRTR2
SCHEMBL4570053 0.79 MALT1 (0.52) EGLN1MALT1
SCHEMBL4570051 0.77 HSD11B1 (0.41) EGLN1MALT1
SCHEMBL17081991 0.75 EGLN1 (0.38) EGLN1MALT1DDB1CRBNHCRTR2
SCHEMBL549652 0.75 EGLN1 (0.38) EGLN1MALT1DDB1CRBNHCRTR2
SCHEMBL550273 0.74 HSD11B1 (0.44) EGLN1MALT1
SCHEMBL17082059 0.74 HSD11B1 (0.44) EGLN1MALT1

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-20120122858-A1 LACTAM COMPOUNDS AND THEIR USE AS PHARMACEUTICALS INCYTE CORPORATION (US) 2012-05-17 US disclosed
US-8110581-B2 Lactam compounds and their use as pharmaceuticals INCYTE CORPORATION (US) 2012-02-07 US disclosed
US-20090291946-A1 LACTAM COMPOUNDS AND THEIR USE AS PHARMACEUTICALS INCYTE CORPORATION (US) 2009-11-26 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 (2 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-20090291946-A1 LACTAM COMPOUNDS AND THEIR USE AS PHARMACEUTICALS HSD11B1, HSD11B2, HSD17B1 EGLN1 2089/4885MALT1 201/4885DDB1 3426/4885
US-20120122858-A1 LACTAM COMPOUNDS AND THEIR USE AS PHARMACEUTICALS HSD11B1, HSD11B2, HSD17B1 EGLN1 2089/4885MALT1 201/4885DDB1 3426/4885

“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.