SCHEMBL7549892

SCHEMBL7549892

O=C(Nc1ccc([N+](=O)[O-])cc1O)Nc1ccccc1OCc1ccccn1

nearest known ligand 0.57

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 7/20 0.57
MEN1 O00255 6/20 0.57
CXCR1 P25024 3/20 0.57
CXCR2 P25025 3/20 0.57
TDP1 Q9NUW8 2/20 0.57
HDAC6 Q9UBN7 1/20 0.57
PPIA P62937 3/20 0.55
MAPT P10636 2/20 0.53
ALDH1A1 P00352 2/20 0.52
PKM P14618 1/20 0.49
CYP19A1 P11511 1/20 0.48
KCNMA1 Q12791 2/20 0.48
PPIF P30405 1/20 0.47
POLB P06746 1/20 0.47
GAA P10253 1/20 0.46
HPGD P15428 1/20 0.46

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
SCHEMBL7489143 0.87 PPIA (0.62) KMT2AMEN1CXCR1CXCR2TDP1
SCHEMBL7484203 0.84 PPIA (0.59) KMT2AMEN1CXCR1CXCR2TDP1
SCHEMBL7486202 0.84 CXCR1 (0.57) KMT2AMEN1CXCR1CXCR2TDP1
SCHEMBL5594899 0.84 KMT2A (0.63) KMT2AMEN1CXCR1CXCR2TDP1
SCHEMBL7549869 0.83 MEN1 (0.62) KMT2AMEN1CXCR1CXCR2TDP1
SCHEMBL3710415 0.82 KMT2A (0.68) KMT2AMEN1CXCR1CXCR2TDP1
SCHEMBL6820169 0.82 KMT2A (0.68) KMT2AMEN1CXCR1CXCR2TDP1
SCHEMBL7549656 0.80 KMT2A (0.57) KMT2AMEN1CXCR1CXCR2TDP1
SCHEMBL7552006 0.80 CXCR2 (0.57) KMT2ACXCR1CXCR2PPIAMAPT
SCHEMBL6823227 0.80 KMT2A (0.67) KMT2AMEN1CXCR1CXCR2TDP1

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 KMT2A 3978/4885MEN1 4754/4885CXCR1 21/4885

“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.