SCHEMBL531523

SCHEMBL531523

CON(C)C(=O)C(C)(C)N(Cc1ccccc1)C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 2/20 0.48
KMT2A Q03164 6/20 0.47
MEN1 O00255 5/20 0.47
HTT P42858 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
RAB9A P51151 5/20 0.42
NPC1 O15118 4/20 0.42
CA12 O43570 1/20 0.42
CA9 Q16790 1/20 0.42
LMNA P02545 2/20 0.42
ALDH1A1 P00352 2/20 0.42
ACHE P22303 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
MAPK1 P28482 1/20 0.40
POLB P06746 1/20 0.40
TSHR P16473 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
SCHEMBL30155506 0.82 MEN1 (0.42) KMT2AMEN1HTTL3MBTL1RAB9A
SCHEMBL18038595 0.77 KMT2A (0.54) RIPK1KMT2AMEN1HTTL3MBTL1
SCHEMBL8773482 0.75 MEN1 (0.69) RIPK1KMT2AMEN1HTTL3MBTL1
SCHEMBL27885169 0.72 MEN1 (0.49) RIPK1KMT2AMEN1HTTL3MBTL1
SCHEMBL30912906 0.72 KMT2A (0.49) RIPK1KMT2AMEN1HTTL3MBTL1
SCHEMBL22035000 0.71 HDAC1 (0.47) RIPK1KMT2AMEN1L3MBTL1RAB9A
SCHEMBL567235 0.70 KMT2A (0.54) RIPK1KMT2AMEN1HTTL3MBTL1
SCHEMBL343793 0.70 KMT2A (0.50) RIPK1KMT2AMEN1RAB9AALDH1A1
SCHEMBL22982786 0.70 NPC1 (0.50) RIPK1KMT2AMEN1RAB9ANPC1
SCHEMBL17275348 0.70 NPC1 (0.50) KMT2AMEN1L3MBTL1RAB9ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2415759-A1 CETP inhibitors Merck Sharp & Dohme Corporation (US) 2012-02-08 EP disclosed
US-20110178059-A1 1,3-OXAZOLIDIN -2-ONE DERIVATIVES USEFUL AS CETP INHIBITORS MERCK SHARP & DOHME CORP. (US) 2011-07-21 US disclosed
US-7915271-B2 1,3-oxazolidin-2-one derivatives useful as CETP inhibitors MERCK SHARP & DOHME CORP. (US) 2011-03-29 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-20110178059-A1 1,3-OXAZOLIDIN -2-ONE DERIVATIVES USEFUL AS CETP INHIBITORS CETP, MTTP, APOB RIPK1 2820/4885KMT2A 2516/4885MEN1 4049/4885

“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.