SCHEMBL4722964

SCHEMBL4722964

N#Cc1ccc(N2CCC3(CC2)CCN([C@H]2CC[C@@H](O)CC2)C3=O)c(F)c1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
KDM4E B2RXH2 1/20 0.40
MAPT P10636 1/20 0.40
FFAR4 Q5NUL3 1/20 0.39
AOC3 Q16853 2/20 0.39
CHRM4 P08173 1/20 0.39
SLC6A9 P48067 5/20 0.39
ADRA1D P25100 1/20 0.39
ADRA1A P35348 1/20 0.39
ADRA1B P35368 1/20 0.39
HSD11B1 P28845 2/20 0.39
KCNH2 Q12809 1/20 0.38
HCRTR1 O43613 1/20 0.38
HCRTR2 O43614 1/20 0.38
USP14 P54578 1/20 0.38
HRH3 Q9Y5N1 2/20 0.38

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
SCHEMBL4829848 1.00 ALDH1A1 (0.40) ALDH1A1SMN1; SMN2KDM4EMAPTFFAR4
SCHEMBL4718438 1.00 ALDH1A1 (0.40) ALDH1A1SMN1; SMN2KDM4EMAPTFFAR4
SCHEMBL4723808 0.91 HCRTR1 (0.40) ALDH1A1SMN1; SMN2KDM4EMAPTFFAR4
SCHEMBL5631278 0.91 HCRTR1 (0.40) ALDH1A1SMN1; SMN2KDM4EMAPTFFAR4
SCHEMBL550161 0.91 SLC6A9 (0.38) ALDH1A1SMN1; SMN2KDM4EMAPTAOC3
SCHEMBL550162 0.91 SLC6A9 (0.38) ALDH1A1SMN1; SMN2KDM4EMAPTAOC3
SCHEMBL4719446 0.87 FFAR4 (0.35) ALDH1A1SMN1; SMN2KDM4EMAPTFFAR4
SCHEMBL5631276 0.87 FFAR4 (0.35) ALDH1A1SMN1; SMN2KDM4EMAPTFFAR4
SCHEMBL4721479 0.85 HSD11B1 (0.36) HSD11B1KCNH2HCRTR1HCRTR2HRH3
SCHEMBL4824424 0.85 HSD11B1 (0.36) HSD11B1KCNH2HCRTR1HCRTR2HRH3

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 11 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
EP-1957494-A2 LACTAM COMPOUNDS AND METHODS OF USING THE SAME Incyte Corporation (US) 2008-08-20 EP claimed
WO-2007067504-A2 LACTAM COMPOUNDS AND METHODS OF USING THE SAME INCYTE CORPORATION (US) 2007-06-14 WO 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
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
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
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 ALDH1A1 94/4885SMN1; SMN2 2604/4885KDM4E 2888/4885

“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.