SCHEMBL6404504

SCHEMBL6404504

CCOC(=O)N1CCN(c2ccc(C3(C(=O)N(C)[C@H]4CC[C@H](O)CC4)CC3)c(F)c2)CC1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 3/20 0.48
MAPT P10636 9/20 0.44
HTT P42858 5/20 0.44
MAPK1 P28482 3/20 0.44
ALDH1A1 P00352 6/20 0.43
LMNA P02545 5/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
HPGD P15428 2/20 0.43
TSHR P16473 2/20 0.43
NPSR1 Q6W5P4 2/20 0.43
CASP1 P29466 1/20 0.43
GAA P10253 2/20 0.43
KDM4E B2RXH2 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.40
USP2 O75604 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
NPC1 O15118 1/20 0.38
ALOX15 P16050 1/20 0.38
HSD17B10 Q99714 1/20 0.38

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
SCHEMBL6404511 1.00 PDK2 (0.48) PDK2MAPTHTTMAPK1ALDH1A1
SCHEMBL6414235 0.91 PDK2 (0.46) PDK2MAPTMAPK1ALDH1A1SMN1; SMN2
SCHEMBL6414231 0.91 PDK2 (0.46) PDK2MAPTMAPK1ALDH1A1SMN1; SMN2
SCHEMBL4963061 0.88 RORC (0.37) PDK2
SCHEMBL4963056 0.88 RORC (0.37) PDK2
SCHEMBL4963030 0.83 PDK2 (0.46) PDK2MAPTHTTMAPK1ALDH1A1
SCHEMBL4963551 0.83 PDK2 (0.46) PDK2MAPTHTTMAPK1ALDH1A1
SCHEMBL6410761 0.83 MAPT (0.43) PDK2MAPTALDH1A1SMN1; SMN2L3MBTL1
SCHEMBL4963131 0.75 PDK2 (0.44) PDK2MAPTALDH1A1SMN1; SMN2L3MBTL1
SCHEMBL4964877 0.74 PDK2 (0.45) PDK2MAPTMAPK1ALDH1A1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050288338-A1 Amido compounds and their use as pharmaceuticals INCYTE CORPORATION 2005-12-29 US claimed
US-20050288338-A1 Amido compounds and their use as pharmaceuticals INCYTE CORPORATION 2005-12-29 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-20050288338-A1 Amido compounds and their use as pharmaceuticals HSD11B1, CYP11B1, HSD11B2 PDK2 1025/4885MAPT 3691/4885HTT 3466/4885

“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.