SCHEMBL7552121

SCHEMBL7552121

Cc1c(NC(=O)Nc2ccc(C#N)cc2NS(=O)(=O)c2ccccc2)cccc1[N+](=O)[O-]

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.54
IDH1 O75874 1/20 0.48
MAPT P10636 6/20 0.47
POLB P06746 4/20 0.47
ALDH1A1 P00352 3/20 0.47
CRHBP P24387 1/20 0.47
CRHR2 Q13324 1/20 0.47
KMT2A Q03164 5/20 0.46
MEN1 O00255 4/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
GAA P10253 1/20 0.46
KDM4E B2RXH2 1/20 0.45
ALOX12 P18054 1/20 0.45
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
TAS1R3 Q7RTX0 1/20 0.44
TAS1R1 Q7RTX1 1/20 0.44
TAS1R2 Q8TE23 1/20 0.44
CYP2C9 P11712 3/20 0.43
CYP2C19 P33261 3/20 0.43

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
SCHEMBL7487873 0.91 POLB (0.50) LMNAMAPTPOLBALDH1A1CRHBP
SCHEMBL8684046 0.87 CA12 (0.50) LMNAMAPTPOLBALDH1A1CRHBP
SCHEMBL7946388 0.86 LMNA (0.58) LMNAIDH1MAPTPOLBALDH1A1
SCHEMBL7557174 0.84 PTGES2 (0.45) LMNAMAPTALDH1A1KMT2AMEN1
SCHEMBL8684465 0.84 CXCR1 (0.43) LMNAMAPTALDH1A1KMT2AMEN1
SCHEMBL7946384 0.83 LMNA (0.57) LMNAIDH1MAPTPOLBALDH1A1
SCHEMBL7487824 0.83 TBXA2R (0.50) POLBALDH1A1GAANPSR1CCR2
SCHEMBL7940030 0.79 HDAC1 (0.50) CCR2
SCHEMBL7496445 0.79 ACLY (0.52) LMNAMAPTALDH1A1KMT2AMEN1
SCHEMBL7490402 0.79 GPR27 (0.51) LMNAMAPTALDH1A1KMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020128321-A1 IL-8 receptor antagonists SMITHKLINE BEECHAM CORPORATION 2002-09-12 US disclosed
US-6262113-B1 HYDROXY- OR MERCAPTO-PHENYLUREAS SMITHKLINE BEECHAM CORPORATION 2001-07-17 US disclosed
US-6211373-B1 Phenyl urea antagonists of the IL-8 receptor SMITHKLINE BEECHAM CORPORATION 2001-04-03 US disclosed
US-5780483-A IL-8 receptor antagonists SMITHKLINE BEECHAM CORPORATION (US) 1998-07-14 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 (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-20020128321-A1 IL-8 receptor antagonists CXCL8, CCR8, IL1RN LMNA 4366/4885IDH1 4570/4885MAPT 698/4885

“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.