SCHEMBL25825561

SCHEMBL25825561

CC(C)NC(=O)Oc1ccc(C(C)C)cc1

nearest known ligand 0.61

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.61
ALDH1A1 P00352 2/20 0.52
KDM4E B2RXH2 1/20 0.52
RAB9A P51151 3/20 0.47
KMT2A Q03164 2/20 0.47
MEN1 O00255 1/20 0.47
HPGD P15428 2/20 0.46
XBP1 P17861 1/20 0.46
MMP2 P08253 1/20 0.46
MAPT P10636 2/20 0.44
PRSS1 P07477 1/20 0.44
ACR P10323 1/20 0.44
NFKB1 P19838 1/20 0.44
NFKB2 Q00653 1/20 0.44
RELA Q04206 1/20 0.44
FAAH O00519 3/20 0.43
NPC1 O15118 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43

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
SCHEMBL6912550 0.85 LIPE (0.54) SMN1; SMN2ALDH1A1RAB9AKMT2AMEN1
SCHEMBL11625128 0.83 SMN1; SMN2 (0.63) SMN1; SMN2ALDH1A1KDM4ERAB9AKMT2A
SCHEMBL4741073 0.81 MMP2 (0.46) SMN1; SMN2ALDH1A1RAB9AKMT2AMEN1
SCHEMBL12132475 0.81 FAAH (0.52) ALDH1A1KDM4EHPGDMMP2MAPT
SCHEMBL1895598 0.81 SLC1A3 (0.57) SMN1; SMN2ALDH1A1KDM4ERAB9AKMT2A
SCHEMBL1714626 0.80 LMNA (0.59) SMN1; SMN2ALDH1A1KDM4ERAB9AKMT2A
SCHEMBL5699582 0.80 SMN1; SMN2 (0.54) SMN1; SMN2ALDH1A1KDM4ERAB9AKMT2A
SCHEMBL12132472 0.79 GAA (0.53) SMN1; SMN2ALDH1A1KMT2AMEN1MAPT
SCHEMBL13992390 0.79 TRPV1 (0.51) SMN1; SMN2ALDH1A1KDM4ERAB9AKMT2A
Hydrogen Peroxide SCHEMBL9578945 0.79 LMNA (0.57) SMN1; SMN2ALDH1A1KDM4ERAB9AKMT2A

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-20230183226-A1 AKT3 MODULATORS Georgiamune Inc. 2023-06-15 US disclosed
US-20230183226-A1 AKT3 MODULATORS Georgiamune Inc. 2023-06-15 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-20230183226-A1 AKT3 MODULATORS AKT3, AKT2, MTOR SMN1; SMN2 2070/4885ALDH1A1 4541/4885KDM4E 4095/4885

“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.