SCHEMBL25922720

SCHEMBL25922720

CCOCCOCCOCCOCCOCCOCCNC

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.39
TSHR P16473 1/20 0.37
THRB P10828 1/20 0.37
KDM4E B2RXH2 1/20 0.33
RECQL P46063 1/20 0.33
HTR1D P28221 1/20 0.33
HTR1B P28222 1/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
EPHX1 P07099 1/20 0.32
NPC1 O15118 1/20 0.31
HPGD P15428 1/20 0.31
RAB9A P51151 1/20 0.31
GAA P10253 1/20 0.31
EPHX2 P34913 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
SCHEMBL6005502 1.00 ALDH1A1 (0.39) ALDH1A1TSHRTHRBKDM4ERECQL
SCHEMBL15082731 1.00 ALDH1A1 (0.39) ALDH1A1TSHRTHRBKDM4ERECQL
SCHEMBL7071314 1.00 ALDH1A1 (0.39) ALDH1A1TSHRTHRBKDM4ERECQL
SCHEMBL19249028 1.00 ALDH1A1 (0.39) ALDH1A1TSHRTHRBKDM4ERECQL
SCHEMBL22269102 1.00 ALDH1A1 (0.39) ALDH1A1TSHRTHRBKDM4ERECQL
SCHEMBL24378505 1.00 ALDH1A1 (0.39) ALDH1A1TSHRTHRBKDM4ERECQL
SCHEMBL126241 0.94
SCHEMBL20075870 0.93 NPC1 (0.35) ALDH1A1TSHRTHRBKDM4EMEN1
SCHEMBL23651532 0.93 KDM4E (0.42) ALDH1A1TSHRTHRBKDM4ERECQL
Hydrochloric Acid SCHEMBL7085471 0.92

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-20230234953-A1 IRAK DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2023-07-27 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-20230234953-A1 IRAK DEGRADERS AND USES THEREOF IRAK2, IRAK3, IRAK1 ALDH1A1 2776/4885TSHR 3319/4885THRB 1824/4885

“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.