SCHEMBL23512422

SCHEMBL23512422

COC(=O)CCSSc1ccccn1

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.51
SMN1; SMN2 Q16637 5/20 0.47
LMNA P02545 2/20 0.47
EHMT2 Q96KQ7 1/20 0.46
EHMT1 Q9H9B1 1/20 0.46
APOBEC3G Q9HC16 1/20 0.46
KMT2A Q03164 3/20 0.44
MAPT P10636 2/20 0.44
RAB9A P51151 5/20 0.44
NPC1 O15118 2/20 0.44
TP53 P04637 1/20 0.44
HPGD P15428 3/20 0.43
MAPK10 P53779 1/20 0.42
RGS12 O14924 1/20 0.42
HDAC1 Q13547 1/20 0.42
HDAC2 Q92769 1/20 0.42
MEN1 O00255 2/20 0.41
PKM P14618 1/20 0.41

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
SCHEMBL15927526 0.92 ALDH1A1 (0.51) ALDH1A1SMN1; SMN2LMNAEHMT2EHMT1
SCHEMBL27383058 0.87 ALDH1A1 (0.42) ALDH1A1SMN1; SMN2LMNAEHMT2EHMT1
SCHEMBL17748162 0.87 ALDH1A1 (0.42) ALDH1A1SMN1; SMN2LMNAEHMT2EHMT1
SCHEMBL17752518 0.87 ALDH1A1 (0.42) ALDH1A1SMN1; SMN2LMNAEHMT2EHMT1
SCHEMBL579460 0.87 ALDH1A1 (0.53) ALDH1A1SMN1; SMN2LMNAEHMT2EHMT1
SCHEMBL18811278 0.86 ALDH1A1 (0.56) ALDH1A1SMN1; SMN2LMNAKMT2ARAB9A
SCHEMBL18805587 0.86 LMNA (0.62) ALDH1A1SMN1; SMN2LMNAEHMT2EHMT1
SCHEMBL15907906 0.86 ALDH1A1 (0.41) ALDH1A1SMN1; SMN2LMNAEHMT2EHMT1
SCHEMBL17072457 0.84 ALDH1A1 (0.42) ALDH1A1SMN1; SMN2LMNAKMT2AMAPT
SCHEMBL10064444 0.83 ALDH1A1 (0.55) ALDH1A1SMN1; SMN2LMNAEHMT2EHMT1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113039191-B Nucleotide analogues 奇异基因组学系统公司 2024-07-16 CN disclosed
US-20210179720-A1 NUCLEIC ACID-POLYPEPTIDE COMPOSITIONS AND USES THEREOF AVIDITY BIOSCIENCES, INC. 2021-06-17 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-20210179720-A1 NUCLEIC ACID-POLYPEPTIDE COMPOSITIONS AND USES THEREOF POLM, POLN, POLI ALDH1A1 4316/4885SMN1; SMN2 465/4885LMNA 280/4885

“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.