SCHEMBL6350885

SCHEMBL6350885

CCCCC(C=CCCCCCCCCCCCCBr)OC(C)=O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 4/20 0.42
ASAH1 Q13510 1/20 0.41
MAPT P10636 2/20 0.41
TP53 P04637 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C9 P11712 1/20 0.41
MAPK1 P28482 1/20 0.41
CYP2C19 P33261 1/20 0.41
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
PRKCA P17252 1/20 0.40
GALR3 O60755 1/20 0.39
CYP3A4 P08684 2/20 0.39
FAAH O00519 1/20 0.39
LPAR1 Q92633 1/20 0.38
USP2 O75604 1/20 0.37
LMNA P02545 1/20 0.37
RECQL P46063 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37

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
SCHEMBL6350887 1.00 PDE4D (0.42) PDE4DASAH1MAPTTP53CYP1A2
SCHEMBL6350880 1.00 PDE4D (0.42) PDE4DASAH1MAPTTP53CYP1A2
SCHEMBL29259205 0.88 MEN1 (0.50) PDE4DMAPTTP53CYP1A2CYP2D6
SCHEMBL500452 0.85 MEN1 (0.46) PDE4DMAPTTP53CYP1A2CYP2D6
SCHEMBL500451 0.85 MEN1 (0.46) PDE4DMAPTTP53CYP1A2CYP2D6
SCHEMBL6354840 0.82 EPHX2 (0.49) PDE4DMAPTTP53CYP1A2CYP2D6
SCHEMBL6354839 0.82 EPHX2 (0.49) PDE4DMAPTTP53CYP1A2CYP2D6
SCHEMBL6137635 0.82 EPHX2 (0.49) PDE4DMAPTTP53CYP1A2CYP2D6
SCHEMBL30368256 0.82 GALR3 (0.47) PDE4DMEN1KMT2AGALR3
SCHEMBL29094957 0.82 MEN1 (0.45) PDE4DMAPTTP53CYP1A2CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050020680-A1 Hydroxyfattysulfonic acid analogs BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM 2005-01-27 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-20050020680-A1 Hydroxyfattysulfonic acid analogs ELANE, HRH2, APEH PDE4D 4214/4885ASAH1 77/4885MAPT 4547/4885

“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.