SCHEMBL20047014

SCHEMBL20047014

C#CCCN1CCS(=O)(=O)CC1

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.35
MEN1 O00255 1/20 0.35
ALDH1A1 P00352 2/20 0.34
PKM P14618 1/20 0.34
CYP1A2 P05177 1/20 0.33
CYP2C19 P33261 1/20 0.33
NPC1 O15118 1/20 0.33
POLB P06746 1/20 0.31

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
SCHEMBL21051896 0.80 KMT2A (0.36) KMT2AMEN1ALDH1A1PKMCYP1A2
SCHEMBL12551017 0.78 ALDH1A1 (0.62) KMT2AMEN1ALDH1A1PKMPOLB
SCHEMBL896956 0.77 KMT2A (0.37) KMT2AMEN1ALDH1A1CYP1A2CYP2C19
SCHEMBL25431154 0.75 ALDH1A1 (0.44) ALDH1A1PKMCYP1A2POLB
SCHEMBL312073 0.75 ALDH1A1 (0.44) ALDH1A1PKMCYP1A2POLB
SCHEMBL3770379 0.74
SCHEMBL25433068 0.74 POLB (0.48) KMT2AALDH1A1PKMPOLB
SCHEMBL1037242 0.72 HRH3 (0.48) KMT2AALDH1A1PKMCYP1A2POLB
SCHEMBL25432585 0.72 HRH3 (0.48) KMT2AALDH1A1PKMCYP1A2POLB
SCHEMBL20858732 0.72 HRH3 (0.48) KMT2AALDH1A1PKMCYP1A2POLB

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
US-20200039943-A1 COMPOUNDS, DEVICES, AND USES THEREOF SIGILON THERAPEUTICS, INC. 2020-02-06 US disclosed
WO-2018067615-A1 COMPOUNDS, DEVICES, AND USES THEREOF SIGILON THERAPEUTICS, INC. (US) 2018-04-12 WO 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-20200039943-A1 COMPOUNDS, DEVICES, AND USES THEREOF SLC10A1, SLCO1B3, SLC5A1 KMT2A 4010/4885MEN1 272/4885ALDH1A1 651/4885

“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.