SCHEMBL23975136

SCHEMBL23975136

O=C(CCCCCCCNC(=O)C1CCCCCCC1)NC1CCCCCC1

nearest known ligand 0.67

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.64
NAAA Q02083 1/20 0.60
EPHX1 P07099 7/20 0.60
HDAC3 O15379 2/20 0.59
HDAC1 Q13547 2/20 0.59
HDAC2 Q92769 2/20 0.59
HDAC10 Q969S8 2/20 0.59
HDAC11 Q96DB2 2/20 0.59
HDAC8 Q9BY41 2/20 0.59
HDAC6 Q9UBN7 2/20 0.59
NCOR2 Q9Y618 1/20 0.59
EPHX2 P34913 4/20 0.52
KEAP1 Q14145 1/20 0.50
NFE2L2 Q16236 1/20 0.50
ALDH1A1 P00352 1/20 0.50

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
SCHEMBL21842291 1.00 SMN1; SMN2 (0.64) SMN1; SMN2NAAAEPHX1HDAC3HDAC1
SCHEMBL23975362 0.98 SMN1; SMN2 (0.66) SMN1; SMN2NAAAEPHX1HDAC3HDAC1
SCHEMBL31501308 0.84 NAAA (0.64) NAAAEPHX1HDAC3HDAC1HDAC2
SCHEMBL31501326 0.84 NAAA (0.64) NAAAEPHX1HDAC3HDAC1HDAC2
SCHEMBL5655426 0.84 NAAA (0.68) SMN1; SMN2NAAAEPHX1EPHX2KEAP1
SCHEMBL7897834 0.84 NAAA (0.68) SMN1; SMN2NAAAEPHX1EPHX2KEAP1
SCHEMBL17172545 0.83 NAAA (0.82) SMN1; SMN2NAAAEPHX1HDAC8HDAC6
SCHEMBL38658755 0.83 SMN1; SMN2 (0.91) SMN1; SMN2EPHX1HDAC3HDAC1HDAC2
SCHEMBL31501321 0.83 NAAA (0.61) SMN1; SMN2NAAAEPHX1HDAC3HDAC1
SCHEMBL9829575 0.82 NAAA (0.65) SMN1; SMN2NAAAEPHX1HDAC8HDAC6

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 SMN1; SMN2 3617/4885NAAA 914/4885EPHX1 2057/4885

“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.