SCHEMBL17817252

SCHEMBL17817252

CCCCCCCCCCCCCC(CS(=O)(=O)O)NCCCCCC

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.43
CA1 P00915 2/20 0.42
CA2 P00918 2/20 0.42
PPARA Q07869 2/20 0.40
EPHX1 P07099 7/20 0.39
GNAI3 P08754 1/20 0.37
GNAO1 P09471 1/20 0.37
GNAI1 P63096 1/20 0.37
EPHX2 P34913 1/20 0.36
GPR84 Q9NQS5 3/20 0.36
FDPS P14324 3/20 0.36
FFAR1 O14842 1/20 0.36

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
Sulfuric Acid SCHEMBL10894755 0.87 TP53 (0.52) TP53CA1CA2PPARAEPHX1
SCHEMBL16586781 0.82 TP53 (0.38) TP53CA1CA2PPARAEPHX2
SCHEMBL16586496 0.82 TP53 (0.38) TP53CA1CA2PPARAEPHX2
SCHEMBL16586628 0.82 TP53 (0.38) TP53CA1CA2PPARAEPHX2
SCHEMBL16586471 0.82 TP53 (0.38) TP53CA1CA2PPARAEPHX2
SCHEMBL16586470 0.82 TP53 (0.38) TP53CA1CA2PPARAEPHX2
SCHEMBL16586448 0.82 TP53 (0.38) TP53CA1CA2PPARAEPHX2
SCHEMBL16586437 0.82 TP53 (0.38) TP53CA1CA2PPARAEPHX2
SCHEMBL31189062 0.82 TP53 (0.43) TP53CA1CA2PPARAEPHX1
SCHEMBL31189067 0.82 TP53 (0.43) TP53CA1CA2PPARAEPHX1

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
WO-2016094226-A1 PREVENTION AND TREATMENT OF INFLAMMATORY CONDITIONS GLYCOREGIMMUNE, INC. (US) 2016-06-16 WO disclosed
US-20160158258-A1 PREVENTION AND TREATMENT OF INFLAMMATORY CONDITIONS ALTIUM GROWTH FUND, LP 2016-06-09 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-20160158258-A1 PREVENTION AND TREATMENT OF INFLAMMATORY CONDITIONS RXRA, RXRG, CX3CR1 TP53 2836/4885CA1 445/4885CA2 925/4885

“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.