SCHEMBL23346142

SCHEMBL23346142

CCCC(C)(CC)n1nc2ccccc2n1

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SLC9A1 P19634 4/20 0.33
KDM4E B2RXH2 3/20 0.32
HPGD P15428 2/20 0.32
ALDH1A1 P00352 1/20 0.32
GAA P10253 1/20 0.32
SLC6A2 P23975 1/20 0.31
MPO P05164 3/20 0.31
POLB P06746 1/20 0.31
HTT P42858 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
SCHEMBL22513528 0.92 KDM4E (0.34) SLC9A1KDM4EHPGDALDH1A1GAA
SCHEMBL19738682 0.88 KDM4E (0.37) SLC9A1KDM4EHPGDALDH1A1GAA
SCHEMBL28718737 0.83
SCHEMBL19738627 0.81 KDM4E (0.34) SLC9A1KDM4EHPGDALDH1A1GAA
SCHEMBL19738601 0.76 KDM4E (0.37) SLC9A1KDM4EHPGDALDH1A1GAA
SCHEMBL3508542 0.73 PPARG (0.39) KDM4EHPGDALDH1A1GAAPOLB
SCHEMBL23207680 0.71 SLC9A1 (0.49) SLC9A1ALDH1A1POLB
SCHEMBL10233410 0.71 HPGD (0.42) SLC9A1KDM4EHPGDHTT
SCHEMBL25508949 0.70 LMNA (0.33) SLC9A1KDM4EHPGDHTT
SCHEMBL28610595 0.70 ALDH1A1 (0.42) KDM4EHPGDALDH1A1GAAHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11767301-B2 Bi-functional molecules to degrade circulating proteins YALE UNIVERSITY (US) 2023-09-26 US disclosed
US-20210145974-A1 Bifunctional Small Molecules to Target the Selective Degradation of Circulating Proteins YALE UNIVERSITY 2021-05-20 US disclosed
US-20210139436-A1 Bi-functional Molecules to Degrade Circulating Proteins YALE UNIVERSITY 2021-05-13 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 (3 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-11767301-B2 Bi-functional molecules to degrade circulating proteins MIF, ASGR1, FCGR2A SLC9A1 4439/4885KDM4E 4546/4885HPGD 2922/4885
US-20210145974-A1 Bifunctional Small Molecules to Target the Selective Degradation of Circulating Proteins ASGR1, LDLR, FCGR3B SLC9A1 4541/4885KDM4E 4160/4885HPGD 4247/4885
US-20210139436-A1 Bi-functional Molecules to Degrade Circulating Proteins MIF, ASGR1, FCGR2A SLC9A1 4439/4885KDM4E 4546/4885HPGD 2922/4885

“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.