SCHEMBL7198626

SCHEMBL7198626

CCCCOc1ccc(CC)cc1CCC(=O)c1ccccc1OCCCC

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.46
CYP3A4 P08684 2/20 0.46
HTR2B P41595 2/20 0.46
SLC6A3 Q01959 2/20 0.46
MEN1 O00255 1/20 0.46
NR1I2 O75469 1/20 0.46
CHRM2 P08172 1/20 0.46
ADRA2A P08913 1/20 0.46
MAPT P10636 1/20 0.46
OPRK1 P41145 1/20 0.46
KMT2A Q03164 1/20 0.46
HDAC6 Q9UBN7 1/20 0.46
ABCB1 P08183 14/20 0.46
TSHR P16473 2/20 0.44
ALDH1A1 P00352 1/20 0.44
LTB4R Q15722 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
PPARG P37231 1/20 0.43
PPARD Q03181 1/20 0.43
PPARA Q07869 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
SCHEMBL7194132 0.96 MEN1 (0.51) LMNACYP3A4HTR2BSLC6A3MEN1
SCHEMBL7197384 0.95 LMNA (0.53) LMNACYP3A4HTR2BSLC6A3MEN1
SCHEMBL7195656 0.94 ABCB1 (0.46) LMNACYP3A4HTR2BSLC6A3MEN1
SCHEMBL7197274 0.90 LTB4R (0.43) LMNACYP3A4HTR2BSLC6A3MEN1
SCHEMBL7194784 0.89 ABCB1 (0.51) LMNACYP3A4HTR2BSLC6A3MAPT
SCHEMBL7193466 0.88 PPARG (0.45) ABCB1LTB4RPPARGPPARDPPARA
SCHEMBL7193453 0.88 PPARG (0.52) LMNACYP3A4HTR2BSLC6A3MEN1
SCHEMBL7198061 0.87 LTB4R (0.47) MEN1MAPTKMT2ATSHRLTB4R
SCHEMBL7188124 0.86 LTB4R (0.47) LMNACYP3A4HTR2BSLC6A3MEN1
SCHEMBL7193783 0.86 THRB (0.46) MEN1MAPTKMT2ALTB4RNPSR1

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 LMNA 1586/4885CYP3A4 254/4885HTR2B 2854/4885

“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.