SCHEMBL24714971

SCHEMBL24714971

CC(C)(C)OC(=O)CN1C(=O)c2ccccc2C1=O

nearest known ligand 0.62

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.60
MEN1 O00255 2/20 0.57
KMT2A Q03164 2/20 0.57
MAPT P10636 2/20 0.57
CA12 O43570 1/20 0.56
CA9 Q16790 1/20 0.56
NPSR1 Q6W5P4 2/20 0.55
POLB P06746 1/20 0.52
NPC1 O15118 2/20 0.50
RAB9A P51151 2/20 0.50
L3MBTL1 Q9Y468 2/20 0.49
KDM4E B2RXH2 1/20 0.49

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
SCHEMBL14876034 0.84 MEN1 (0.55) ALDH1A1MEN1KMT2AMAPTPOLB
SCHEMBL30143437 0.84 MEN1 (0.52) ALDH1A1MEN1KMT2AMAPTCA12
SCHEMBL11327841 0.84 HPGD (0.58) ALDH1A1MEN1KMT2AMAPTPOLB
SCHEMBL7091522 0.83 ALDH1A1 (0.67) ALDH1A1MEN1KMT2AMAPTPOLB
SCHEMBL14876503 0.82 CASP1 (0.52) ALDH1A1MEN1KMT2AMAPTNPSR1
SCHEMBL4701921 0.82 ALDH1A1 (0.52) ALDH1A1MEN1KMT2AMAPTCA12
SCHEMBL12638925 0.81 KMT2A (0.61) ALDH1A1MEN1KMT2AMAPTRAB9A
SCHEMBL524126 0.81 ALDH1A1 (0.67) ALDH1A1MEN1KMT2AMAPTCA12
SCHEMBL5879642 0.81 CDC25A (0.49) ALDH1A1KMT2ANPSR1POLB
SCHEMBL5879644 0.81 CDC25A (0.49) ALDH1A1KMT2ANPSR1POLB

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
US-20230167058-A1 GPX4 COMPOUNDS AND COMPOSITIONS AND METHODS OF TREATMENT USING SAME THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK 2023-06-01 US disclosed
US-20230167058-A1 GPX4 COMPOUNDS AND COMPOSITIONS AND METHODS OF TREATMENT USING SAME THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK 2023-06-01 US disclosed
WO-2022219485-A1 A SCALABLE PROCESS FOR THE PREPARATION OF SUBSTANTIALLY PURE GLYCINE TERT-BUTYL ESTER AND ITS SALT THEREOF HIKAL LIMITED (IN) 2022-10-20 WO 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-20230167058-A1 GPX4 COMPOUNDS AND COMPOSITIONS AND METHODS OF TREATMENT USING SAME GPX4, GPX1, AIFM2 ALDH1A1 915/4885MEN1 1684/4885KMT2A 2198/4885

“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.