SCHEMBL14831024

SCHEMBL14831024

CCCCCCCCCCCCC[C@H](O)CC(=O)C(C)(C)N

nearest known ligand 0.59

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 8/20 0.59
FFAR1 O14842 3/20 0.49
FFAR4 Q5NUL3 2/20 0.49
NFKB1 P19838 1/20 0.43
CA2 P00918 1/20 0.42
GRIK1 P39086 1/20 0.41
GRIK2 Q13002 1/20 0.41
ACACB O00763 1/20 0.41
ACACA Q13085 1/20 0.41
FAAH O00519 1/20 0.41
PSMD14 O00487 1/20 0.40
PLA2G1B P04054 1/20 0.40
HSP90AA1 P07900 1/20 0.40
MMP2 P08253 1/20 0.40
ATG4B Q9Y4P1 1/20 0.40
TRPV1 Q8NER1 1/20 0.40

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
SCHEMBL14830348 1.00 GPR84 (0.59) GPR84FFAR1FFAR4NFKB1CA2
SCHEMBL23554231 0.85 GPR84 (0.63) GPR84FFAR1FFAR4NFKB1CA2
SCHEMBL15374693 0.85 GPR84 (0.63) GPR84FFAR1FFAR4NFKB1CA2
SCHEMBL14830350 0.82 GPR84 (0.59) GPR84FFAR1FFAR4NFKB1CA2
SCHEMBL14830349 0.82 GPR84 (0.59) GPR84FFAR1FFAR4NFKB1CA2
SCHEMBL29221781 0.80 GPR84 (0.62) GPR84FFAR1FFAR4FAAH
SCHEMBL8171086 0.77 GPR84 (0.68) GPR84FFAR1FFAR4NFKB1FAAH
SCHEMBL6800461 0.77 GPR84 (0.68) GPR84FFAR1FFAR4NFKB1FAAH
SCHEMBL8177703 0.77 GPR84 (0.68) GPR84FFAR1FFAR4NFKB1FAAH
SCHEMBL8179521 0.77 GPR84 (0.68) GPR84FFAR1FFAR4NFKB1FAAH

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-20140309275-A1 Sphingosine Analogs, Compositions, and Methods Related Thereto UNIV EMORY (US) 2014-10-16 US disclosed
EP-2760820-A2 SPHINGOSINE ANALOGS, COMPOSITIONS, AND METHODS RELATED THERETO Emory University (US) 2014-08-06 EP disclosed
WO-2013049280-A2 SPHINGOSINE ANALOGS, COMPOSITIONS, AND METHODS RELATED THERETO EMORY UNIVERSITY (US) 2013-04-04 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-20140309275-A1 Sphingosine Analogs, Compositions, and Methods Related Thereto SPHK1, S1PR1, S1PR2 GPR84 1521/4885FFAR1 755/4885FFAR4 1594/4885

“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.