SCHEMBL1699712

SCHEMBL1699712

Cc1c(C(O)C(=O)O)c(OS(=O)(=O)C(F)(F)F)c2ccccc2c1Br

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CXCR2 P25025 2/20 0.32
CXCR1 P25024 1/20 0.32
LMNA P02545 2/20 0.30
MAPK1 P28482 1/20 0.30

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
SCHEMBL15093426 0.89 CXCR2 (0.34) CXCR2CXCR1LMNAMAPK1
SCHEMBL1699539 0.89 MAPT (0.38) LMNA
SCHEMBL15165314 0.89 MAPT (0.38) LMNA
SCHEMBL1699623 0.87 CXCR2 (0.33) CXCR2CXCR1LMNAMAPK1
SCHEMBL1699562 0.84 CXCR2 (0.32) CXCR2CXCR1
SCHEMBL1699514 0.79 TUBB4A (0.34) CXCR2CXCR1LMNAMAPK1
SCHEMBL1699726 0.79 MAPT (0.35) CXCR2LMNA
SCHEMBL15165315 0.79 MAPT (0.35) CXCR2LMNA
SCHEMBL16657248 0.78 HTT (0.39) LMNAMAPK1
SCHEMBL15099628 0.78 HTT (0.39) LMNAMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2588450-B1 NAPHT-2-YLACETIC ACID DERIVATIVES TO TREAT AIDS GILEAD SCIENCES INC (US) 2017-05-24 EP disclosed
US-9102614-B2 Naphth-2-ylacetic acid derivatives to treat AIDS GILEAD SCIENCES, INC. (US) 2015-08-11 US disclosed
US-20130203727-A1 NAPHT-2-YLACETIC ACID DERIVATIVES TO TREAT AIDS GILEAD SCIENCES, INC. (US) 2013-08-08 US disclosed
EP-2588450-A1 NAPHT- 2 -YLACETIC ACID DERIVATIVES TO TREAT AIDS Gilead Sciences, Inc. (US) 2013-05-08 EP disclosed
WO-2012003497-A1 NAPHT- 2 -YLACETIC ACID DERIVATIVES TO TREAT AIDS GILEAD SCIENCES, INC. (US) 2012-01-05 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-20130203727-A1 NAPHT-2-YLACETIC ACID DERIVATIVES TO TREAT AIDS NFATC1, AADAT, ACAT1 CXCR2 2468/4885CXCR1 1538/4885LMNA 710/4885

“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.