SCHEMBL23975359

SCHEMBL23975359

O=C(CCOCCOCCOCCOCCNC1CCCCCC1)NCCCCCCCCNC(=O)C1CCCCC1

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.50
KEAP1 Q14145 1/20 0.42
NFE2L2 Q16236 1/20 0.42
CHRM1 P11229 1/20 0.39
EPHX2 P34913 3/20 0.39
NPC1 O15118 1/20 0.39
PKM P14618 1/20 0.39
RAB9A P51151 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
NAMPT P43490 1/20 0.39
EPHX1 P07099 5/20 0.39
CXCR4 P61073 1/20 0.39
KMT2A Q03164 2/20 0.38
MEN1 O00255 1/20 0.38
SIGMAR1 Q99720 1/20 0.37

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
SCHEMBL21842289 1.00 NAAA (0.50) NAAAKEAP1NFE2L2CHRM1EPHX2
SCHEMBL23975140 1.00 NAAA (0.50) NAAAKEAP1NFE2L2CHRM1EPHX2
SCHEMBL23975361 0.94 SMN1; SMN2 (0.44) NAAAKEAP1NFE2L2CHRM1EPHX2
SCHEMBL21842360 0.94 SMN1; SMN2 (0.44) NAAAKEAP1NFE2L2CHRM1EPHX2
SCHEMBL23975365 0.94 SMN1; SMN2 (0.44) NAAAKEAP1NFE2L2CHRM1EPHX2
SCHEMBL23975357 0.86 SMN1; SMN2 (0.50) NAAAKEAP1NFE2L2CHRM1EPHX2
SCHEMBL23975143 0.84 SMN1; SMN2 (0.48) NAAAKEAP1NFE2L2CHRM1EPHX2
SCHEMBL26158778 0.81 SMN1; SMN2 (0.48) NAAAKEAP1NFE2L2CHRM1EPHX2
SCHEMBL23975372 0.81 NAAA (0.68) NAAAKEAP1NFE2L2EPHX2NAMPT
SCHEMBL23975246 0.81 NAAA (0.68) NAAAKEAP1NFE2L2EPHX2NAMPT

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-20210338825-A1 DEGRADERS OF HEPATITIS C VIRUS NS3/4A PROTEIN DANA-FARBER CANCER INSTITUTE, INC. (US) 2021-11-04 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-20210338825-A1 DEGRADERS OF HEPATITIS C VIRUS NS3/4A PROTEIN HAVCR2, CUL4A, PSMC3 NAAA 914/4885KEAP1 194/4885NFE2L2 2020/4885

“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.