SCHEMBL2700902

SCHEMBL2700902

O=C1N([C@H]2CC[C@H](O)CC2)CC[C@@]12CCCN(c1ccc(N3CCCC3)cn1)C2

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.38
PIK3CA P42336 1/20 0.37
HSD11B1 P28845 1/20 0.37
CRBN Q96SW2 4/20 0.37
DDB1 Q16531 1/20 0.37
TTK P33981 2/20 0.36
PLK1 P53350 1/20 0.36
HRH3 Q9Y5N1 1/20 0.33
MAPK8 P45983 1/20 0.33
UBE2T Q9NPD8 1/20 0.33
CDK4 P11802 2/20 0.33
CCND1 P24385 2/20 0.33
MCHR1 Q99705 2/20 0.33
MAP4K1 Q92918 2/20 0.33
CCND2 P30279 1/20 0.33
CCND3 P30281 1/20 0.33
HCRTR1 O43613 1/20 0.32
HCRTR2 O43614 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
SCHEMBL551043 1.00 MAPT (0.38) MAPTPIK3CAHSD11B1CRBNDDB1
SCHEMBL2700906 1.00 MAPT (0.38) MAPTPIK3CAHSD11B1CRBNDDB1
SCHEMBL554628 1.00 MAPT (0.38) MAPTPIK3CAHSD11B1CRBNDDB1
SCHEMBL554629 1.00 MAPT (0.38) MAPTPIK3CAHSD11B1CRBNDDB1
SCHEMBL551044 1.00 MAPT (0.38) MAPTPIK3CAHSD11B1CRBNDDB1
SCHEMBL550340 0.88 CRBN (0.41) PIK3CAHSD11B1CRBNDDB1HRH3
SCHEMBL2700795 0.88 CRBN (0.41) PIK3CAHSD11B1CRBNDDB1HRH3
SCHEMBL549661 0.88 CRBN (0.41) PIK3CAHSD11B1CRBNDDB1HRH3
SCHEMBL550339 0.88 CRBN (0.41) PIK3CAHSD11B1CRBNDDB1HRH3
SCHEMBL549662 0.88 CRBN (0.41) PIK3CAHSD11B1CRBNDDB1HRH3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2450351-A1 Lactam compounds and their use as pharmaceuticals Incyte Corporation (US) 2012-05-09 EP claimed
US-20060116382-A1 Lactam compounds and their use as pharmaceuticals INCYTE CORPORATION 2006-06-01 US claimed
EP-1812005-B1 LACTAM COMPOUNDS AND THEIR USE AS PHARMACEUTICALS INCYTE CORP (US) 2015-09-16 EP disclosed
EP-2450351-A1 Lactam compounds and their use as pharmaceuticals Incyte Corporation (US) 2012-05-09 EP disclosed
US-20060116382-A1 Lactam compounds and their use as pharmaceuticals INCYTE CORPORATION 2006-06-01 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-20060116382-A1 Lactam compounds and their use as pharmaceuticals HSD11B1, HSD11B2, HSD17B1 MAPT 3735/4885PIK3CA 599/4885HSD11B1 1/4885

“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.