SCHEMBL19358915

SCHEMBL19358915

Cc1ccc(S(=O)(=O)NCc2ccc(CNC(=O)c3cccc(Cl)c3)cc2)cc1

nearest known ligand 0.67

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ CA1 P00915 2/20 0.67
▸ CA2 P00918 2/20 0.67
▸ GPR17 Q13304 1/20 0.62
▸ MAPT P10636 4/20 0.61
▸ MEN1 O00255 3/20 0.61
▸ KMT2A Q03164 3/20 0.61
▸ ALDH1A1 P00352 1/20 0.61
▸ HTT P42858 1/20 0.60
▸ TP53 P04637 2/20 0.60
▸ LMNA P02545 1/20 0.60
▸ POLB P06746 2/20 0.57
▸ TUBB P07437 1/20 0.57
▸ CYP19A1 P11511 1/20 0.55
▸ SMN1; SMN2 Q16637 1/20 0.55
▸ RAB9A P51151 1/20 0.54
▸ OPRK1 P41145 1/20 0.53

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
SCHEMBL19358854 0.90 HTT (0.75) CA1CA2ALDH1A1HTTLMNA
SCHEMBL19358850 0.90 CA1 (0.72) CA1CA2GPR17MAPTMEN1
SCHEMBL19358883 0.86 MAPT (0.63) CA1CA2MAPTMEN1KMT2A
SCHEMBL19358841 0.86 MEN1 (0.75) MAPTMEN1KMT2AALDH1A1HTT
SCHEMBL19358924 0.86 MAPT (0.74) MAPTMEN1KMT2AALDH1A1HTT
SCHEMBL19358844 0.84 MAPT (0.65) MAPTMEN1KMT2AALDH1A1HTT
SCHEMBL19358853 0.84 TP53 (0.81) MAPTMEN1KMT2AALDH1A1TP53
SCHEMBL19358881 0.82 HTT (0.75) CA1CA2GPR17MAPTMEN1
SCHEMBL15953394 0.82 HTT (0.79) CA1CA2MAPTMEN1KMT2A
SCHEMBL19358909 0.81 MAPT (0.56) MAPTMEN1KMT2AALDH1A1TP53

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 CA1 2023/4885CA2 1700/4885GPR17 80/4885
US-10669270-B2 Amide-sulfamide derivatives, compositions, and uses related to CXCR4 inhibition CXCR4, CXCL12, CXCR2 CA1 2023/4885CA2 1700/4885GPR17 80/4885

“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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