SCHEMBL19358909

SCHEMBL19358909

Cc1ccc(S(=O)(=O)NCc2ccc(CNC(=O)c3c(Cl)cc(Cl)cc3Cl)cc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.56
▸ LMNA P02545 2/20 0.56
▸ TP53 P04637 2/20 0.56
▸ ALDH1A1 P00352 4/20 0.54
▸ USP2 O75604 1/20 0.54
▸ MEN1 O00255 2/20 0.54
▸ POLB P06746 2/20 0.54
▸ KMT2A Q03164 2/20 0.54
▸ TUBB P07437 1/20 0.54
▸ CA12 O43570 1/20 0.52
▸ CYP1A2 P05177 1/20 0.52
▸ CYP3A4 P08684 1/20 0.52
▸ ATM Q13315 1/20 0.52
▸ CA9 Q16790 1/20 0.52
▸ L3MBTL1 Q9Y468 1/20 0.52
▸ HPGD P15428 1/20 0.52
▸ NAMPT P43490 1/20 0.52
▸ CYP19A1 P11511 1/20 0.51

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
SCHEMBL19358849 0.88 TUBB (0.61) MAPTLMNATP53MEN1POLB
SCHEMBL19358841 0.83 MEN1 (0.75) MAPTLMNATP53ALDH1A1MEN1
SCHEMBL19358915 0.81 CA1 (0.67) MAPTLMNATP53ALDH1A1MEN1
SCHEMBL19358866 0.81 MEN1 (0.60) MAPTLMNATP53ALDH1A1USP2
SCHEMBL19358853 0.81 TP53 (0.81) MAPTLMNATP53ALDH1A1USP2
SCHEMBL5960116 0.79 MEN1 (0.73) MAPTLMNATP53ALDH1A1MEN1
SCHEMBL13744671 0.79 HPGD (0.53) TP53ALDH1A1MEN1POLBKMT2A
SCHEMBL19358924 0.78 MAPT (0.74) MAPTLMNATP53ALDH1A1MEN1
SCHEMBL25547142 0.77 CA12 (0.83) LMNATP53ALDH1A1USP2MEN1
SCHEMBL19358850 0.77 CA1 (0.72) MAPTLMNATP53ALDH1A1USP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3429588-B1 AMIDE-SULFAMIDE DERIVATIVES, COMPOSITIONS, AND USES RELATED TO CXCR4 INHIBITION UNIV EMORY (US) 2024-09-18 — — EP disclosed
US-10669270-B2 Amide-sulfamide derivatives, compositions, and uses related to CXCR4 inhibition EMORY UNIVERSITY (US) 2020-06-02 — — US disclosed
US-20190084980-A1 Amide-Sulfamide Derivatives, Compositions, and Uses Related to CXCR4 Inhibition EMORY UNIVERSITY (US) 2019-03-21 — — US disclosed
EP-3429588-A1 AMIDE-SULFAMIDE DERIVATIVES, COMPOSITIONS, AND USES RELATED TO CXCR4 INHIBITION Emory University (US) 2019-01-23 — — EP disclosed
WO-2017160832-A1 AMIDE-SULFAMIDE DERIVATIVES, COMPOSITIONS, AND USES RELATED TO CXCR4 INHIBITION EMORY UNIVERSITY (US) 2017-09-21 — — WO 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 (2 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-20190084980-A1 Amide-Sulfamide Derivatives, Compositions, and Uses Related to CXCR4 Inhibition CXCR4, CXCL12, CXCR2 MAPT 4641/4885LMNA 4001/4885TP53 2641/4885
US-10669270-B2 Amide-sulfamide derivatives, compositions, and uses related to CXCR4 inhibition CXCR4, CXCL12, CXCR2 MAPT 4641/4885LMNA 4001/4885TP53 2641/4885

“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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