SCHEMBL23975138

SCHEMBL23975138

O=C(NCCCCCOC1CCCCCC1)C1CCCC1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.62
KEAP1 Q14145 1/20 0.51
NFE2L2 Q16236 1/20 0.51
SMN1; SMN2 Q16637 2/20 0.47
NPC1 O15118 1/20 0.47
PKM P14618 1/20 0.47
EPHX2 P34913 1/20 0.47
RAB9A P51151 1/20 0.47
NAMPT P43490 1/20 0.46
KMT2A Q03164 3/20 0.45
MEN1 O00255 2/20 0.45
EPHX1 P07099 1/20 0.45
GNAI3 P08754 1/20 0.43
GNAO1 P09471 1/20 0.43
GNAI1 P63096 1/20 0.43
ESR1 P03372 1/20 0.43
TERT O14746 1/20 0.41
DRD2 P14416 2/20 0.40
DRD3 P35462 2/20 0.40
HSD17B10 Q99714 1/20 0.40

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
SCHEMBL23975364 1.00 NAAA (0.62) NAAAKEAP1NFE2L2SMN1; SMN2NPC1
SCHEMBL23975247 0.94 NAAA (0.57) NAAAKEAP1NFE2L2SMN1; SMN2NPC1
SCHEMBL17172545 0.85 NAAA (0.82) NAAAKEAP1NFE2L2SMN1; SMN2NPC1
SCHEMBL21842362 0.83 KDM4E (0.52) NAAAEPHX2EPHX1ADRA1A
SCHEMBL28417481 0.82 NAAA (0.42) NAAASMN1; SMN2NPC1EPHX2EPHX1
SCHEMBL22837666 0.79 NAAA (0.59) NAAAKEAP1NFE2L2SMN1; SMN2NPC1
SCHEMBL23975246 0.79 NAAA (0.68) NAAAKEAP1NFE2L2EPHX2NAMPT
SCHEMBL21842323 0.79 NAAA (0.68) NAAAKEAP1NFE2L2EPHX2NAMPT
SCHEMBL23975372 0.79 NAAA (0.68) NAAAKEAP1NFE2L2EPHX2NAMPT
SCHEMBL27886094 0.78 NAAA (0.58) NAAAKEAP1NFE2L2SMN1; SMN2NPC1

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.