SCHEMBL3338457

SCHEMBL3338457

Oc1cc(CSc2cccc(F)c2F)nc2cc(-c3cccs3)nn12

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CXCR2 P25025 12/20 0.45
KDM4E B2RXH2 2/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
RXFP1 Q9HBX9 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.40
MEN1 O00255 2/20 0.39
ALDH1A1 P00352 2/20 0.39
KMT2A Q03164 2/20 0.39
FYN P06241 1/20 0.39
MAPT P10636 2/20 0.39
HPGD P15428 1/20 0.39
TP53 P04637 1/20 0.38
POLB P06746 1/20 0.38

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
SCHEMBL3336538 0.86 CXCR2 (0.49) CXCR2FYN
SCHEMBL3337830 0.85 CXCR2 (0.52) CXCR2KDM4EFYNMAPTTP53
SCHEMBL2638147 0.83 CXCR2 (0.52) CXCR2TP53
SCHEMBL3339100 0.83 CXCR2 (0.46) CXCR2MEN1KMT2AMAPTTP53
SCHEMBL3340295 0.83 CXCR2 (0.48) CXCR2KDM4EL3MBTL1SMN1; SMN2MEN1
SCHEMBL3340936 0.82 CXCR2 (0.48) CXCR2FYN
SCHEMBL3343196 0.82 CXCR2 (0.57) CXCR2L3MBTL1
SCHEMBL3338974 0.82 CXCR2 (0.43) CXCR2
SCHEMBL3343769 0.81 CXCR2 (0.56) CXCR2KDM4ESMN1; SMN2MEN1ALDH1A1
SCHEMBL3340855 0.81 CXCR2 (0.45) CXCR2

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-20100152205-A1 CXCR2 INHIBITORS NOVARTIS AG 2010-06-17 US claimed
EP-2094697-A1 5-SULFANYLMETHYL-PYRAZOLO [1,5-A]PYRIMIDIN-7-OL DERIVATIVES AS CXCR2 ANTAGONISTS Novartis AG (CH) 2009-09-02 EP claimed
WO-2008062026-A1 5-SULFANYLMETHYL-PYRAZOLO [1,5-A] PYRIMIDIN-7-OL DERIVATIVES AS CXCR2 ANTAGONISTS NOVARTIS AG (CH) 2008-05-29 WO claimed
US-20100152205-A1 CXCR2 INHIBITORS NOVARTIS AG 2010-06-17 US disclosed
US-20100152205-A1 CXCR2 INHIBITORS NOVARTIS AG 2010-06-17 US disclosed
US-20100152205-A1 CXCR2 INHIBITORS NOVARTIS AG 2010-06-17 US disclosed
WO-2008062026-A1 5-SULFANYLMETHYL-PYRAZOLO [1,5-A] PYRIMIDIN-7-OL DERIVATIVES AS CXCR2 ANTAGONISTS NOVARTIS AG (CH) 2008-05-29 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 (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-20100152205-A1 CXCR2 INHIBITORS CXCR2, CXCR1, CXCR3 CXCR2 1/4885KDM4E 4638/4885L3MBTL1 4102/4885

“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.