SCHEMBL23975247

SCHEMBL23975247

O=C(NCCCOC1CCCCC1)C1CCCCC1

nearest known ligand 0.65

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.57
SMN1; SMN2 Q16637 2/20 0.52
EPHX2 P34913 2/20 0.52
NPC1 O15118 1/20 0.52
PKM P14618 1/20 0.52
RAB9A P51151 1/20 0.52
KMT2A Q03164 4/20 0.50
MEN1 O00255 2/20 0.50
KEAP1 Q14145 1/20 0.50
NFE2L2 Q16236 1/20 0.50
EPHX1 P07099 1/20 0.47
TSHR P16473 3/20 0.44
ALDH1A1 P00352 2/20 0.44
CYP3A4 P08684 1/20 0.43
HSD17B10 Q99714 1/20 0.42

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
SCHEMBL23975138 0.94 NAAA (0.62) NAAASMN1; SMN2EPHX2NPC1PKM
SCHEMBL23975364 0.94 NAAA (0.62) NAAASMN1; SMN2EPHX2NPC1PKM
SCHEMBL22652025 0.81 NAAA (0.63) NAAASMN1; SMN2EPHX2NPC1PKM
SCHEMBL17172545 0.80 NAAA (0.82) NAAASMN1; SMN2EPHX2NPC1PKM
SCHEMBL27699972 0.79 NAAA (0.55) NAAASMN1; SMN2EPHX2NPC1PKM
SCHEMBL28417481 0.78 NAAA (0.42) NAAASMN1; SMN2EPHX2NPC1EPHX1
SCHEMBL3184451 0.78 NAAA (0.66) NAAASMN1; SMN2EPHX2NPC1PKM
SCHEMBL18412281 0.78 NAAA (0.54) NAAASMN1; SMN2EPHX2NPC1PKM
SCHEMBL20794256 0.77 NAAA (0.66) NAAASMN1; SMN2EPHX2NPC1PKM
SCHEMBL15426780 0.77 NAAA (0.66) NAAASMN1; SMN2EPHX2NPC1PKM

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 914/4885SMN1; SMN2 3617/4885EPHX2 1972/4885

“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.