SCHEMBL2699360

SCHEMBL2699360

O=C1N([C@H]2CC[C@H](O)CC2)CC[C@@]12CCCN(c1nccc(F)n1)C2

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HCRTR2 O43614 7/20 0.39
HCRTR1 O43613 6/20 0.39
CRBN Q96SW2 1/20 0.38
HSD11B1 P28845 7/20 0.37
HTR1A P08908 1/20 0.36
TSPO P30536 1/20 0.36
CYP1A2 P05177 2/20 0.33
CYP2D6 P10635 2/20 0.33
USP2 O75604 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
HIF1A Q16665 1/20 0.33
ACACB O00763 1/20 0.33
LCAT P04180 1/20 0.33
ALDH1A1 P00352 1/20 0.32
CYP3A4 P08684 1/20 0.32
HSD17B10 Q99714 1/20 0.32
KDM4E B2RXH2 1/20 0.32
POLB P06746 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
SCHEMBL550445 1.00 HCRTR2 (0.39) HCRTR2HCRTR1CRBNHSD11B1HTR1A
SCHEMBL550612 1.00 HCRTR2 (0.39) HCRTR2HCRTR1CRBNHSD11B1HTR1A
SCHEMBL2699363 1.00 HCRTR2 (0.39) HCRTR2HCRTR1CRBNHSD11B1HTR1A
SCHEMBL550446 1.00 HCRTR2 (0.39) HCRTR2HCRTR1CRBNHSD11B1HTR1A
SCHEMBL550613 1.00 HCRTR2 (0.39) HCRTR2HCRTR1CRBNHSD11B1HTR1A
SCHEMBL550719 0.88 HSD11B1 (0.41) HCRTR2HCRTR1CRBNHSD11B1HTR1A
SCHEMBL550718 0.88 HSD11B1 (0.41) HCRTR2HCRTR1CRBNHSD11B1HTR1A
SCHEMBL550959 0.87 CYP2D6 (0.43) HCRTR2HSD11B1CYP1A2CYP2D6CYP2C9
SCHEMBL551508 0.87 CYP2D6 (0.43) HCRTR2HSD11B1CYP1A2CYP2D6CYP2C9
SCHEMBL2700526 0.87 CYP2D6 (0.43) HCRTR2HSD11B1CYP1A2CYP2D6CYP2C9

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
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-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 HCRTR2 3116/4885HCRTR1 2917/4885CRBN 2898/4885

“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.