SCHEMBL5069200

SCHEMBL5069200

CC(C)(C)N(CC[C@H](O)c1ccccc1)C(=O)O

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 1/20 0.53
MEN1 O00255 5/20 0.45
KMT2A Q03164 5/20 0.45
HTT P42858 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
KDM4E B2RXH2 3/20 0.43
ATM Q13315 1/20 0.43
LMNA P02545 3/20 0.43
AOC3 Q16853 2/20 0.41
ALDH1A1 P00352 1/20 0.40
CHRNB2 P17787 1/20 0.40
CHRNB4 P30926 1/20 0.40
CHRNA3 P32297 1/20 0.40
CHRNA4 P43681 1/20 0.40
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
BCAT2 O15382 1/20 0.39

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
SCHEMBL1529441 1.00 RIPK1 (0.53) RIPK1MEN1KMT2AHTTL3MBTL1
SCHEMBL5065804 1.00 RIPK1 (0.53) RIPK1MEN1KMT2AHTTL3MBTL1
SCHEMBL5065045 0.86 AOC3 (0.43) RIPK1MEN1KMT2AHTTL3MBTL1
SCHEMBL5069163 0.84 ADRB3 (0.41) MEN1KMT2A
SCHEMBL5069157 0.83 AOC3 (0.51) RIPK1MEN1KMT2AHTTL3MBTL1
SCHEMBL1527256 0.83 AOC3 (0.51) RIPK1MEN1KMT2AHTTL3MBTL1
SCHEMBL5069152 0.83 AOC3 (0.51) RIPK1MEN1KMT2AHTTL3MBTL1
SCHEMBL7395984 0.83 RIPK1 (0.45) RIPK1MEN1KMT2AHTTL3MBTL1
SCHEMBL1529611 0.83 KDM4E (0.42) RIPK1MEN1KMT2AHTTL3MBTL1
SCHEMBL23631381 0.81 KDM4E (0.41) RIPK1MEN1KMT2AHTTL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080318947-A1 Inhibitors of Akt Activity HEERDING DIRK A 2008-12-25 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-20080318947-A1 Inhibitors of Akt Activity PI4KB, PIK3CA, AKT2 RIPK1 326/4885MEN1 3151/4885KMT2A 1852/4885

“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.