SCHEMBL7196635

SCHEMBL7196635

CCCCCCOc1ccc(OCCCCCC)c(CCC(=O)c2cccc(OCCCCCC)c2OCCCCCC)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTB4R Q15722 2/20 0.50
THRA P10827 9/20 0.47
THRB P10828 9/20 0.47
PTPN11 Q06124 2/20 0.46
MEN1 O00255 1/20 0.45
NR1I2 O75469 1/20 0.45
LMNA P02545 1/20 0.45
CHRM2 P08172 1/20 0.45
CYP3A4 P08684 1/20 0.45
ADRA2A P08913 1/20 0.45
MAPT P10636 1/20 0.45
OPRK1 P41145 1/20 0.45
HTR2B P41595 1/20 0.45
SLC6A3 Q01959 1/20 0.45
KMT2A Q03164 1/20 0.45
HDAC6 Q9UBN7 1/20 0.45
PTGES O14684 1/20 0.44
ALOX5 P09917 1/20 0.44
PPARG P37231 1/20 0.44
PLA2G4B P0C869 1/20 0.43

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
SCHEMBL7189170 0.99 LTB4R (0.48) LTB4RTHRATHRBPTPN11MEN1
SCHEMBL7189191 0.97 PPARG (0.47) LTB4RTHRATHRBLMNAMAPT
SCHEMBL7194866 0.92 MTNR1A (0.47) LTB4RLMNAMAPTKMT2APTGES
SCHEMBL7190716 0.90 LMNA (0.54) LTB4RTHRATHRBPTPN11MEN1
SCHEMBL7194147 0.89 LMNA (0.52) LTB4RTHRATHRBPTPN11MEN1
SCHEMBL7194170 0.88 LTB4R (0.49) LTB4RTHRATHRBPTPN11MEN1
SCHEMBL7191712 0.88 THRB (0.50) LTB4RTHRATHRBPTPN11PTGES
SCHEMBL7188124 0.87 LTB4R (0.47) LTB4RTHRATHRBPTPN11MEN1
SCHEMBL7198468 0.87 THRB (0.48) LTB4RTHRATHRBPTPN11PTGES
SCHEMBL7194122 0.86 THRA (0.49) LTB4RTHRATHRBMEN1NR1I2

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-20030065039-A1 Biologically active 1,3-bis-aromatic-prop-2-en-1-ones, 1,3-bis-aromatic-propan-1-ones, and 1,3-bis-aromatic-prop-2-yn-1-ones STATENS SERUM INSTITUTE (DK) 2003-04-03 US claimed

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-20030065039-A1 Biologically active 1,3-bis-aromatic-prop-2-en-1-ones, 1,3-bis-aromatic-propan-1-ones, and 1,3-bis-aromatic-prop-2-yn-1-ones AKR1C3, AKR1C1, AKR1A1 LTB4R 506/4885THRA 2660/4885THRB 2309/4885

“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.