SCHEMBL5711780

SCHEMBL5711780

CN1CCCN(S(=O)(=O)c2c(Cl)ccc3nc(C(C)(C)C)oc23)CC1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 1/20 0.46
▸ KMT2A Q03164 3/20 0.45
▸ LMNA P02545 1/20 0.45
▸ POLB P06746 1/20 0.42
▸ CXCR2 P25025 3/20 0.41
▸ APOBEC3A P31941 1/20 0.41
▸ APOBEC3G Q9HC16 1/20 0.41
▸ PKM P14618 2/20 0.40
▸ CYP2C19 P33261 1/20 0.38
▸ L3MBTL1 Q9Y468 4/20 0.38
▸ ATM Q13315 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ HTT P42858 1/20 0.36

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
SCHEMBL1563090 0.96 POLB (0.45) RAB9AKMT2ALMNAPOLBCXCR2
SCHEMBL17293485 0.91 ALDH1A1 (0.40) KMT2ALMNAPOLBL3MBTL1ATM
SCHEMBL17293323 0.90 TSHR (0.41) KMT2ALMNAPOLBCYP2C19L3MBTL1
SCHEMBL17293536 0.84 ALDH1A1 (0.44) KMT2ALMNACYP2C19L3MBTL1ALDH1A1
SCHEMBL13774876 0.83 USP2 (0.43) KMT2ALMNACXCR2PKMCYP2C19
SCHEMBL9978081 0.83 SPR (0.35) KMT2ALMNACYP2C19ATMALDH1A1
SCHEMBL9977972 0.82 LMNA (0.46) KMT2ALMNAPOLBALDH1A1MEN1
SCHEMBL17293478 0.81 MAPT (0.33) KMT2ALMNAPOLBPKMATM
SCHEMBL17293383 0.81 HSD11B1 (0.42) KMT2ALMNAATMALDH1A1MEN1
SCHEMBL3041529 0.81 NAMPT (0.40) KMT2ALMNAL3MBTL1ALDH1A1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1351933-B1 IL-8 RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORP (US) 2006-11-22 — — EP disclosed
US-20060084641-A1 IL-8 receptor antagonists SMITHKLINE BEECHAM CORPORATION 2006-04-20 — — US disclosed
EP-1351933-A4 IL-8 RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORP (US) 2005-09-07 — — EP disclosed
US-20040048897-A1 Il-8 receptor antagonists SMITHKLINE BEECHAM CORPORATION 2004-03-11 — — US disclosed
EP-1351933-A1 IL-8 RECEPTOR ANTAGONISTS SmithKline Beecham Corporation (US) 2003-10-15 — — EP disclosed
WO-2002057230-A1 IL-8 RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 2002-07-25 — — 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-20040048897-A1 Il-8 receptor antagonists CXCL8, CCR8, TLR8 RAB9A 1229/4885KMT2A 2291/4885LMNA 4799/4885
US-20060084641-A1 IL-8 receptor antagonists CXCL8, CCR8, TLR8 RAB9A 1229/4885KMT2A 2291/4885LMNA 4799/4885

“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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