SCHEMBL24476394

SCHEMBL24476394

COC(=O)CCCCCCCCCCCCCCn1c(C)nc2nc(Cl)nc(Cl)c21

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ KAT2B Q92831 3/20 0.40
▸ FAAH O00519 3/20 0.39
▸ DYRK1A Q13627 3/20 0.39
▸ ALDH1A1 P00352 2/20 0.37
▸ TP53 P04637 2/20 0.36
▸ LMNA P02545 1/20 0.35
▸ TLR7 Q9NYK1 1/20 0.34
▸ P2RX3 P56373 1/20 0.33
▸ TSHR P16473 1/20 0.33
▸ CA1 P00915 1/20 0.33
▸ CA2 P00918 1/20 0.33
▸ CSNK2A2 P19784 1/20 0.33
▸ CSNK2B P67870 1/20 0.33
▸ CSNK2A1 P68400 1/20 0.33
▸ HDAC1 Q13547 1/20 0.33
▸ CSNK2A3 Q8NEV1 1/20 0.33
▸ HDAC6 Q9UBN7 1/20 0.33

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
SCHEMBL28674999 0.82 FAAH (0.32) FAAH
SCHEMBL28654092 0.79 TLR8 (0.34) LMNATSHRCSNK2A2CSNK2BCSNK2A1
SCHEMBL28654939 0.79 TLR8 (0.34) LMNATSHRCSNK2A2CSNK2BCSNK2A1
SCHEMBL28659861 0.79 TLR8 (0.34) LMNATSHRCSNK2A2CSNK2BCSNK2A1
SCHEMBL28667945 0.77 KAT2B (0.42) KAT2BFAAHDYRK1AALDH1A1TP53
SCHEMBL28657767 0.77 AMPD1 (0.43) KAT2BFAAHDYRK1ACSNK2A1HDAC1
SCHEMBL28662851 0.77 AMPD1 (0.43) KAT2BFAAHDYRK1ACSNK2A1HDAC1
SCHEMBL28648960 0.76 CYP1A2 (0.36) DYRK1AALDH1A1TSHRCSNK2A2CSNK2B
SCHEMBL28655073 0.76 DGKA (0.35) FAAHALDH1A1LMNATSHR
SCHEMBL28664906 0.75 EPHX2 (0.36) FAAHALDH1A1TLR7

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-20220168309-A1 COMPOUNDS, COMPOSITIONS, AND METHODS FOR THE TREATMENT OF DISEASE INVOX PHARMA LIMITED (GB) 2022-06-02 — — US disclosed
CN-113645977-A Compounds, compositions and methods for treatment of disease F-星治疗公司 2021-11-12 — — CN 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-20220168309-A1 COMPOUNDS, COMPOSITIONS, AND METHODS FOR THE TREATMENT OF DISEASE STING1, CGAS, MAVS KAT2B 3876/4885FAAH 3326/4885DYRK1A 4773/4885

“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.

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