SCHEMBL23221024

SCHEMBL23221024

CCCCCN(C)C1CCC(CC)CC1

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ADH1C P00326 1/20 0.43
ADH1A P07327 1/20 0.43
ADH4 P08319 1/20 0.43
DNM1 Q05193 3/20 0.38
KDM4E B2RXH2 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.32
LSS P48449 2/20 0.32
SPHK1 Q9NYA1 1/20 0.32
CYP1A2 P05177 1/20 0.30
GRIN2B Q13224 1/20 0.30

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
SCHEMBL25829078 0.98 ADH1C (0.46) ADH1CADH1AADH4DNM1KDM4E
SCHEMBL1680185 0.89 ADH1C (0.50) ADH1CADH1AADH4DNM1KDM4E
SCHEMBL23767402 0.89 ADH1C (0.50) ADH1CADH1AADH4DNM1KDM4E
SCHEMBL11569526 0.87 ADH1C (0.53) ADH1CADH1AADH4DNM1KDM4E
SCHEMBL11570725 0.87 ADH1C (0.53) ADH1CADH1AADH4DNM1KDM4E
SCHEMBL1678954 0.87 ADH1C (0.53) ADH1CADH1AADH4DNM1KDM4E
SCHEMBL24508728 0.86 ADH1C (0.42) ADH1CADH1AADH4DNM1KDM4E
SCHEMBL24437737 0.83 DNM1 (0.44) ADH1CADH1AADH4DNM1KDM4E
SCHEMBL1678797 0.83
SCHEMBL23560474 0.82 ADH1C (0.39) ADH1CADH1AADH4DNM1

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-20210228562-A1 IRAK DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2021-07-29 US disclosed
EP-2928898-B1 BETA-LACTAMASE INHIBITORS VENATORX PHARMACEUTICALS INC (US) 2021-04-14 EP 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-20210228562-A1 IRAK DEGRADERS AND USES THEREOF IRAK2, IRAK3, IRAK1 ADH1C 4321/4885ADH1A 4306/4885ADH4 3368/4885

“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.