SCHEMBL549527

SCHEMBL549527

O=C1N(C2CCC(O)CC2)CC[C@]12CCCN(c1ncc(F)cc1F)C2

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 11/20 0.36
RIPK1 Q13546 1/20 0.34
CHRM4 P08173 1/20 0.33
NPY5R Q15761 2/20 0.32
BMPR1A P36894 1/20 0.32
ACVRL1 P37023 1/20 0.32
ACVR1 Q04771 1/20 0.32
CHRM2 P08172 1/20 0.32
CHRM5 P08912 1/20 0.32
CHRM1 P11229 1/20 0.32
PDE4A P27815 1/20 0.32
OPRK1 P41145 1/20 0.31
ADRA2C P18825 1/20 0.31

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
SCHEMBL550783 1.00 HSD11B1 (0.36) HSD11B1RIPK1CHRM4NPY5RBMPR1A
SCHEMBL551124 1.00 HSD11B1 (0.36) HSD11B1RIPK1CHRM4NPY5RBMPR1A
SCHEMBL551031 1.00 HSD11B1 (0.36) HSD11B1RIPK1CHRM4NPY5RBMPR1A
SCHEMBL2699309 1.00 HSD11B1 (0.36) HSD11B1RIPK1CHRM4NPY5RBMPR1A
SCHEMBL550782 1.00 HSD11B1 (0.36) HSD11B1RIPK1CHRM4NPY5RBMPR1A
SCHEMBL549526 1.00 HSD11B1 (0.36) HSD11B1RIPK1CHRM4NPY5RBMPR1A
SCHEMBL2699313 1.00 HSD11B1 (0.36) HSD11B1RIPK1CHRM4NPY5RBMPR1A
SCHEMBL2699862 1.00 HSD11B1 (0.36) HSD11B1RIPK1CHRM4NPY5RBMPR1A
SCHEMBL5630802 0.90 HSD11B1 (0.37) HSD11B1RIPK1CHRM4NPY5ROPRK1
SCHEMBL5630452 0.90 HSD11B1 (0.37) HSD11B1RIPK1CHRM4NPY5ROPRK1

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-8563570-B2 Lactam compounds and their use as pharmaceuticals INCYTE CORPORATION (US) 2013-10-22 US claimed
US-20120122858-A1 LACTAM COMPOUNDS AND THEIR USE AS PHARMACEUTICALS INCYTE CORPORATION (US) 2012-05-17 US claimed
US-20090291946-A1 LACTAM COMPOUNDS AND THEIR USE AS PHARMACEUTICALS INCYTE CORPORATION (US) 2009-11-26 US claimed
US-8563570-B2 Lactam compounds and their use as pharmaceuticals INCYTE CORPORATION (US) 2013-10-22 US disclosed
US-20120122858-A1 LACTAM COMPOUNDS AND THEIR USE AS PHARMACEUTICALS INCYTE CORPORATION (US) 2012-05-17 US disclosed
US-8110581-B2 Lactam compounds and their use as pharmaceuticals INCYTE CORPORATION (US) 2012-02-07 US disclosed
US-20090291946-A1 LACTAM COMPOUNDS AND THEIR USE AS PHARMACEUTICALS INCYTE CORPORATION (US) 2009-11-26 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 (2 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-20090291946-A1 LACTAM COMPOUNDS AND THEIR USE AS PHARMACEUTICALS HSD11B1, HSD11B2, HSD17B1 HSD11B1 1/4885RIPK1 4388/4885CHRM4 3944/4885
US-20120122858-A1 LACTAM COMPOUNDS AND THEIR USE AS PHARMACEUTICALS HSD11B1, HSD11B2, HSD17B1 HSD11B1 1/4885RIPK1 4388/4885CHRM4 3944/4885

“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.