SCHEMBL7196360

SCHEMBL7196360

CCCCCOc1cc(OCCCCC)c(OCCCCC)c(C(=O)CCc2cc(CC)ccc2OCCCCC)c1

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LTB4R Q15722 1/20 0.42
THRA P10827 8/20 0.41
THRB P10828 8/20 0.41
HTT P42858 3/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
MAPT P10636 2/20 0.40
MAPK1 P28482 2/20 0.40
NPC1 O15118 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
RAD52 P43351 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
CNR1 P21554 1/20 0.38
CNR2 P34972 1/20 0.38
PTPN1 P18031 1/20 0.38
PTPN6 P29350 1/20 0.38
PTPN11 Q06124 1/20 0.38
APAF1 O14727 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38

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
SCHEMBL7193815 0.99 LTB4R (0.44) LTB4RTHRATHRBHTTMEN1
SCHEMBL7190213 0.97 MTNR1A (0.40) LTB4RTHRATHRB
SCHEMBL7197617 0.94 SLC5A1 (0.41) SMN1; SMN2L3MBTL1
SCHEMBL7198468 0.90 THRB (0.48) LTB4RTHRATHRBPTPN11
SCHEMBL7191712 0.89 THRB (0.50) LTB4RTHRATHRBPTPN11
SCHEMBL7193783 0.88 THRB (0.46) LTB4RTHRATHRBHTTMEN1
SCHEMBL7196520 0.88 MTNR1A (0.46) LTB4RTHRATHRBL3MBTL1
SCHEMBL7196593 0.87 THRB (0.47) LTB4RTHRATHRBPTPN1PTPN6
SCHEMBL7188124 0.86 LTB4R (0.47) LTB4RTHRATHRBHTTMEN1
SCHEMBL7193466 0.85 PPARG (0.45) LTB4RTHRATHRB

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.