SCHEMBL22803448

SCHEMBL22803448

CCC(C)C(=O)NCCC(C)(C)OCCC(C)(C)C(=O)C(C)C

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.35
CYP1A2 P05177 1/20 0.32
USP2 O75604 1/20 0.31
TSHR P16473 1/20 0.31
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL24918911 0.89 USP2 (0.31) GAAUSP2TSHRMEN1KMT2A
SCHEMBL22965794 0.89 CYP1A2 (0.35) CYP1A2MEN1KMT2A
SCHEMBL24287398 0.80 CYP1A2 (0.36) GAACYP1A2
SCHEMBL24433308 0.80 KMT2A (0.31) MEN1KMT2A
SCHEMBL22803191 0.77 KMT2A (0.33) MEN1KMT2A
SCHEMBL25641230 0.76 CYP1A2 (0.34) CYP1A2
SCHEMBL22965558 0.76 CYP1A2 (0.40) CYP1A2
SCHEMBL24433208 0.76 CYP1A2 (0.33) CYP1A2MEN1KMT2A
SCHEMBL18484956 0.75 KMT2A (0.36) CYP1A2MEN1KMT2A
SCHEMBL25003849 0.74 MEN1 (0.33) GAAMEN1KMT2A

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-20200390895-A1 UNIVERSAL ABT COMPOUNDS AND USES THEREOF KLEO PHARMACEUTICALS, INC. 2020-12-17 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-20200390895-A1 UNIVERSAL ABT COMPOUNDS AND USES THEREOF CD47, MCL1, BCL9 GAA 2911/4885CYP1A2 4647/4885USP2 1016/4885

“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.