SCHEMBL7195028

SCHEMBL7195028

CCc1ccc(OCC(C)C)c(CCC(=O)c2cc(OCC(C)C)cc(OCC(C)C)c2OCC(C)C)c1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FOS P01100 2/20 0.47
JUN P05412 2/20 0.47
ALDH1A1 P00352 2/20 0.40
HIF1A Q16665 1/20 0.40
ABCB1 P08183 5/20 0.36
PPARG P37231 7/20 0.35
PPARD Q03181 7/20 0.35
PPARA Q07869 6/20 0.35
PTGER1 P34995 1/20 0.35
PKM P14618 2/20 0.35
MAPT P10636 1/20 0.35
TSHR P16473 1/20 0.35
HTT P42858 1/20 0.35
AKT1 P31749 1/20 0.34
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33

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
SCHEMBL7194764 0.89 FOS (0.53) FOSJUNALDH1A1HIF1AABCB1
SCHEMBL7189702 0.88 FOS (0.52) FOSJUNALDH1A1HIF1AABCB1
SCHEMBL7198862 0.86 FOS (0.45) FOSJUNALDH1A1HIF1AABCB1
SCHEMBL7193306 0.84 FOS (0.53) FOSJUNALDH1A1HIF1AABCB1
SCHEMBL7196415 0.84 FOS (0.45) FOSJUNALDH1A1HIF1APPARG
SCHEMBL7190189 0.84 SLC5A1 (0.39) ALDH1A1PKMTSHRHTTAKT1
SCHEMBL7197617 0.83 SLC5A1 (0.41) PPARGPPARDPPARAAKT1
SCHEMBL7188107 0.82 FOS (0.45) FOSJUNALDH1A1HIF1APPARG
SCHEMBL7190213 0.82 MTNR1A (0.40) PPARGPPARDPPARA
SCHEMBL7196360 0.81 LTB4R (0.42) MAPTHTTNPC1

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 FOS 1004/4885JUN 961/4885ALDH1A1 88/4885

“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.