SCHEMBL15891771

SCHEMBL15891771

CCc1ccccc1B1OC2CC3CC(C3(C)C)C2(C)O1

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ CXCR2 P25025 1/20 0.53
▸ PREP P48147 7/20 0.44
▸ PSMB5 P28074 7/20 0.41
▸ PSEN1 P49768 1/20 0.39
▸ PSEN2 P49810 1/20 0.39
▸ APH1B Q8WW43 1/20 0.39
▸ NCSTN Q92542 1/20 0.39
▸ APH1A Q96BI3 1/20 0.39
▸ PSENEN Q9NZ42 1/20 0.39
▸ F2 P00734 4/20 0.38
▸ PRSS1 P07477 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
SCHEMBL15780083 0.91 CXCR2 (0.51) CXCR2PREPPSMB5PSEN1PSEN2
SCHEMBL15890142 0.88 CXCR2 (0.49) CXCR2PREPPSMB5PSEN1PSEN2
SCHEMBL13197066 0.88 CXCR2 (0.51) CXCR2PREPPSMB5PSEN1PSEN2
SCHEMBL29664854 0.80 CXCR2 (0.43) CXCR2PREPPSMB5PSEN1PSEN2
SCHEMBL5899514 0.80 CXCR2 (0.42) CXCR2PREPPSMB5PSEN1PSEN2
SCHEMBL5899540 0.80 CXCR2 (0.42) CXCR2PREPPSMB5PSEN1PSEN2
SCHEMBL12721154 0.79 PREP (0.48) CXCR2PREPPSMB5PSEN1PSEN2
SCHEMBL21012782 0.75 CXCR2 (0.40) CXCR2PREPPSMB5PSEN1PSEN2
SCHEMBL27269578 0.75 CXCR2 (0.40) CXCR2PREPPSMB5PSEN1PSEN2
SCHEMBL12960965 0.74 CXCR2 (0.42) CXCR2PREPPSMB5F2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8981106-B2 Pyrimidinecarboxamides as CXCR2 modulators SYNTRIX BIOSYSTEMS, INC. (US) 2015-03-17 — — US disclosed
US-20140206647-A1 PYRIMIDINECARBOXAMIDES AS CXCR2 MODULATORS SYNTRIX BIOSYSTEMS, INC. (US) 2014-07-24 — — 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-20140206647-A1 PYRIMIDINECARBOXAMIDES AS CXCR2 MODULATORS CXCR2, CXCR1, CXCR3 CXCR2 1/4885PREP 1555/4885PSMB5 3872/4885

“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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