SCHEMBL7551297

SCHEMBL7551297

O=C(Nc1cc(-c2ccccc2)ccc1O)Nc1ccccc1-c1ccccc1

nearest known ligand 0.63

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 15/20 0.63
KDM4E B2RXH2 1/20 0.63
APOBEC3A P31941 1/20 0.63
GFER P55789 1/20 0.63
APOBEC3G Q9HC16 1/20 0.63
HDAC2 Q92769 1/20 0.61
HDAC3 O15379 1/20 0.53
CA12 O43570 1/20 0.53
CA1 P00915 1/20 0.53
CA2 P00918 1/20 0.53
CA9 Q16790 1/20 0.53
RET P07949 1/20 0.51
FLT1 P17948 1/20 0.51
KDR P35968 1/20 0.51
MAPK14 Q16539 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
SCHEMBL5594888 0.84 HDAC1 (0.67) HDAC1KDM4EAPOBEC3AGFERAPOBEC3G
SCHEMBL34420050 0.83 CA12 (0.64) KDM4ECA12CA1CA2CA9
SCHEMBL5595264 0.82 RET (0.54) CA12CA1CA2CA9RET
SCHEMBL5594774 0.81 CXCR2 (0.72) KDM4ECA12CA1CA2CA9
SCHEMBL5664848 0.80 CA12 (0.65) HDAC1KDM4EAPOBEC3AGFERAPOBEC3G
SCHEMBL5595100 0.80 MEN1 (0.61) HDAC1KDM4EAPOBEC3AGFERAPOBEC3G
SCHEMBL5595123 0.79 CYP1A2 (0.73) KDM4ECA12CA1CA2CA9
SCHEMBL5595432 0.78 RET (0.56) KDM4ECA12CA1CA2CA9
SCHEMBL4665439 0.78 HDAC1 (1.00) HDAC1KDM4EAPOBEC3AGFERAPOBEC3G
SCHEMBL29776946 0.77 CA12 (0.70) KDM4ECA12CA1CA2CA9

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 7 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-6180675-B1 THERAPY FOR CHEMOKINE SENSITIVE DISEASE; USING A AROMATIC (THIO)UREA COMPOUND SMITHKLINE BEECHAM CORPORATION 2001-01-30 US disclosed
US-6005008-A IL-8 receptor antagonists SMITHKLINE BEECHAM CORPORATION (US) 1999-12-21 US disclosed
US-5886044-A IL-8 receptor antagonists SMITHKLINE BEECHAM CORPORATION (US) 1999-03-23 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 HDAC1 2345/4885KDM4E 3818/4885APOBEC3A 4602/4885

“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.