SCHEMBL4719581

SCHEMBL4719581

O=C1N(C2CCC(O)CC2)CCC12CCN(c1cc(-c3ccncc3)ccc1F)CC2

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 7/20 0.45
CDC7 O00311 1/20 0.38
CDK9 P50750 1/20 0.38
WDR5 P61964 3/20 0.35
SCN9A Q15858 1/20 0.35
HCRTR1 O43613 1/20 0.35
HCRTR2 O43614 1/20 0.35
NPY5R Q15761 2/20 0.34
TOP2A P11388 1/20 0.34
TOP2B Q02880 1/20 0.34
FASN P49327 2/20 0.34
FFAR4 Q5NUL3 1/20 0.34

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
SCHEMBL5629543 1.00 HSD11B1 (0.45) HSD11B1CDC7CDK9WDR5SCN9A
SCHEMBL4721723 0.86 TTR (0.37) HSD11B1CDC7CDK9WDR5NPY5R
SCHEMBL5630487 0.86 TTR (0.37) HSD11B1CDC7CDK9WDR5NPY5R
SCHEMBL9100788 0.84 CDK8 (0.42) FASN
SCHEMBL9100798 0.84 CDK8 (0.42) FASN
SCHEMBL5629422 0.83 HSD11B1 (0.41) HSD11B1WDR5NPY5RFFAR4
SCHEMBL4720506 0.83 HSD11B1 (0.41) HSD11B1WDR5NPY5RFFAR4
SCHEMBL4721598 0.82 MAP3K14 (0.38) SCN9A
SCHEMBL4762976 0.82 MAP3K14 (0.38) SCN9A
SCHEMBL5631223 0.81 HSD11B1 (0.37) HSD11B1SCN9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8193207-B2 Lactam compounds and methods of using the same INCYTE CORPORATION (US) 2012-06-05 US claimed
US-20070129345-A1 Lactam compounds and methods of using the same INCYTE CORPORATION 2007-06-07 US claimed
US-8193207-B2 Lactam compounds and methods of using the same INCYTE CORPORATION (US) 2012-06-05 US disclosed
EP-1957494-A2 LACTAM COMPOUNDS AND METHODS OF USING THE SAME Incyte Corporation (US) 2008-08-20 EP disclosed
WO-2007067504-A2 LACTAM COMPOUNDS AND METHODS OF USING THE SAME INCYTE CORPORATION (US) 2007-06-14 WO disclosed
US-20070129345-A1 Lactam compounds and methods of using the same INCYTE CORPORATION 2007-06-07 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-20070129345-A1 Lactam compounds and methods of using the same HSD11B1, HSD17B11, HSD17B1 HSD11B1 1/4885CDC7 2608/4885CDK9 2232/4885

“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.