SCHEMBL4723808

SCHEMBL4723808

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

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HCRTR1 O43613 1/20 0.40
HCRTR2 O43614 1/20 0.40
FFAR4 Q5NUL3 2/20 0.39
HSD11B1 P28845 7/20 0.39
ALDH1A1 P00352 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
KDM4E B2RXH2 1/20 0.38
MAPT P10636 1/20 0.38
BACE1 P56817 1/20 0.38
KCNJ1 P48048 1/20 0.38
PDE4A P27815 1/20 0.36
HTR2A P28223 2/20 0.35
HTR2C P28335 2/20 0.35
ALK Q9UM73 1/20 0.35
HTR2B P41595 1/20 0.35
FASN P49327 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
SCHEMBL5631278 1.00 HCRTR1 (0.40) HCRTR1HCRTR2FFAR4HSD11B1ALDH1A1
SCHEMBL4718438 0.91 ALDH1A1 (0.40) HCRTR1HCRTR2FFAR4HSD11B1ALDH1A1
SCHEMBL4829848 0.91 ALDH1A1 (0.40) HCRTR1HCRTR2FFAR4HSD11B1ALDH1A1
SCHEMBL4722964 0.91 ALDH1A1 (0.40) HCRTR1HCRTR2FFAR4HSD11B1ALDH1A1
SCHEMBL4719446 0.87 FFAR4 (0.35) HCRTR1HCRTR2FFAR4HSD11B1ALDH1A1
SCHEMBL5631276 0.87 FFAR4 (0.35) HCRTR1HCRTR2FFAR4HSD11B1ALDH1A1
SCHEMBL4718410 0.83 HSD11B1 (0.39) FFAR4HSD11B1BACE1
SCHEMBL5630400 0.83 HSD11B1 (0.39) FFAR4HSD11B1BACE1
SCHEMBL4824424 0.83 HSD11B1 (0.36) HCRTR1HCRTR2HSD11B1BACE1PDE4A
SCHEMBL4721479 0.83 HSD11B1 (0.36) HCRTR1HCRTR2HSD11B1BACE1PDE4A

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 7 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
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 HCRTR1 4094/4885HCRTR2 4496/4885FFAR4 4151/4885

“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.