SCHEMBL15093249

SCHEMBL15093249

CC(C)(C)OC(C(=O)O)c1c(CBr)c(CBr)c2ccccc2c1OS(=O)(=O)C(F)(F)F

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CXCR2 P25025 2/20 0.32
CXCR1 P25024 1/20 0.31
PER2 O15055 1/20 0.31
CRY1 Q16526 1/20 0.31
CRY2 Q49AN0 1/20 0.31

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
SCHEMBL15099642 0.90 HTT (0.35)
SCHEMBL15093729 0.85 CXCR2 (0.36) CXCR2CXCR1PER2CRY1CRY2
SCHEMBL15093533 0.82 CXCR2 (0.34) CXCR2CXCR1PER2CRY1CRY2
SCHEMBL1699562 0.82 CXCR2 (0.32) CXCR2CXCR1
SCHEMBL1699711 0.81 CXCR2 (0.33) CXCR2CXCR1
SCHEMBL15094499 0.78 CXCR2 (0.31) CXCR2CXCR1PER2CRY1CRY2
SCHEMBL1699634 0.78 CYP3A4 (0.33) CXCR2CXCR1
SCHEMBL1699508 0.77 PSIP1 (0.35) CXCR2CXCR1
SCHEMBL15093185 0.77 PSIP1 (0.33) CXCR2CXCR1
SCHEMBL15093213 0.77 PSIP1 (0.32) CXCR2CXCR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9284323-B2 Naphthalene acetic acid derivatives against HIV infection GILEAD SCIENCES, INC. (US) 2016-03-15 US disclosed
US-20150111891-A1 NAPHTHALENE ACETIC ACID DERIVATIVES AGAINST HIV INFECTION GILEAD SCIENCES, INC. (US) 2015-04-23 US disclosed
WO-2013103738-A1 NAPTHALENE ACETIC ACID DERIVATIVES AGAINST HIV INFECTION GILEAD SCIENCES, INC. (US) 2013-07-11 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-20150111891-A1 NAPHTHALENE ACETIC ACID DERIVATIVES AGAINST HIV INFECTION NFATC1, ACIN1, NAAA CXCR2 757/4885CXCR1 413/4885PER2 1966/4885

“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.