SCHEMBL4570134

SCHEMBL4570134

CC(C)COC(=O)Nc1ccc(N2CCC[C@]3(CCN([C@H]4CC[C@H](O)CC4)C3=O)C2)c(F)c1

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.37
KDM4E B2RXH2 1/20 0.36
P2RX3 P56373 3/20 0.36
PDE7A Q13946 3/20 0.35
HSD11B1 P28845 1/20 0.34
RORC P51449 1/20 0.34
NPY2R P49146 5/20 0.33
MEN1 O00255 1/20 0.33
MAPT P10636 1/20 0.33
KMT2A Q03164 1/20 0.33
MTOR P42345 1/20 0.33

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
SCHEMBL17082095 1.00 SMN1; SMN2 (0.37) SMN1; SMN2KDM4EP2RX3PDE7AHSD11B1
SCHEMBL4570084 0.92 L3MBTL1 (0.38) SMN1; SMN2KDM4EP2RX3PDE7ARORC
SCHEMBL17082034 0.92 L3MBTL1 (0.38) SMN1; SMN2KDM4EP2RX3PDE7ARORC
SCHEMBL4570161 0.91 SMN1; SMN2 (0.37) SMN1; SMN2KDM4EP2RX3PDE7ARORC
SCHEMBL17082099 0.91 SMN1; SMN2 (0.37) SMN1; SMN2KDM4EP2RX3PDE7ARORC
SCHEMBL4570135 0.91 ALDH1A1 (0.38) SMN1; SMN2KDM4EP2RX3PDE7ANPY2R
SCHEMBL17082101 0.91 ALDH1A1 (0.38) SMN1; SMN2KDM4EP2RX3PDE7ANPY2R
SCHEMBL4570139 0.90 ALK (0.36) SMN1; SMN2MAPT
SCHEMBL17082089 0.90 ALK (0.36) SMN1; SMN2MAPT
SCHEMBL4570133 0.90 SMN1; SMN2 (0.42) SMN1; SMN2KDM4EP2RX3PDE7ANPY2R

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
US-20120122858-A1 LACTAM COMPOUNDS AND THEIR USE AS PHARMACEUTICALS INCYTE CORPORATION (US) 2012-05-17 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-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
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 SMN1; SMN2 3517/4885KDM4E 3021/4885P2RX3 3732/4885
US-20120122858-A1 LACTAM COMPOUNDS AND THEIR USE AS PHARMACEUTICALS HSD11B1, HSD11B2, HSD17B1 SMN1; SMN2 3517/4885KDM4E 3021/4885P2RX3 3732/4885

“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.