SCHEMBL23640558

SCHEMBL23640558

CCCCCCC(CCCC)CCCCNC=O

nearest known ligand 0.72

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ADH1B P00325 4/20 0.72
ADH1A P07327 4/20 0.72
ADH7 P40394 4/20 0.72
EPHX1 P07099 4/20 0.72
ADH1C P00326 3/20 0.72
ADH4 P08319 2/20 0.72
LMNA P02545 1/20 0.48
TSHR P16473 4/20 0.42
ALDH1A1 P00352 2/20 0.42
CYP3A4 P08684 1/20 0.42
DNM1 Q05193 1/20 0.38
DPP7 Q9UHL4 1/20 0.38
FAAH O00519 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
TRPV1 Q8NER1 1/20 0.38
CA2 P00918 1/20 0.37

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
SCHEMBL23640543 0.98 ADH1B (0.69) ADH1BADH1AADH7EPHX1ADH1C
SCHEMBL23640389 0.98 EPHX1 (0.75) ADH1BADH1AADH7EPHX1ADH1C
SCHEMBL23640595 0.96 EPHX1 (0.72) ADH1BADH1AADH7EPHX1ADH1C
SCHEMBL8043725 0.96 EPHX1 (0.72) ADH1BADH1AADH7EPHX1ADH1C
SCHEMBL19996858 0.94 ADH1B (0.63) ADH1BADH1AADH7EPHX1ADH1C
SCHEMBL19415950 0.90 ADH1B (0.61) ADH1BADH1AADH7EPHX1ADH1C
SCHEMBL9658779 0.85 EPHX1 (1.00) ADH1BADH1AADH7EPHX1ADH1C
SCHEMBL305123 0.85 EPHX1 (1.00) ADH1BADH1AADH7EPHX1ADH1C
SCHEMBL4879688 0.85 EPHX1 (1.00) ADH1BADH1AADH7EPHX1ADH1C
SCHEMBL9661679 0.85 EPHX1 (1.00) ADH1BADH1AADH7EPHX1ADH1C

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-20210214316-A1 ANTI-CANCER NUCLEAR HORMONE RECEPTOR-TARGETING COMPOUNDS SAGARD HOLDINGS MANAGER LP, AS ADMINISTRATIVE AGENT (CA) 2021-07-15 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-20210214316-A1 ANTI-CANCER NUCLEAR HORMONE RECEPTOR-TARGETING COMPOUNDS NCOA1, NCOR1, NCOA3 ADH1B 3100/4885ADH1A 2575/4885ADH7 3673/4885

“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.