SCHEMBL7198516

SCHEMBL7198516

CCc1ccc(OC)c(CCC(=O)c2cc(OC)cc(OC)c2)c1

nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.46
ACHE P22303 1/20 0.44
NPC1 O15118 1/20 0.44
LMNA P02545 1/20 0.44
HTT P42858 1/20 0.44
MEN1 O00255 1/20 0.42
TSHR P16473 1/20 0.42
KMT2A Q03164 1/20 0.42
CALM1 P0DP23 1/20 0.42
NFKB1 P19838 1/20 0.42
NFKB2 Q00653 1/20 0.42
RELA Q04206 1/20 0.42

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
SCHEMBL7195034 0.88 ALDH1A1 (0.52) POLBACHENPC1MEN1KMT2A
SCHEMBL7196742 0.84 SLC5A1 (0.42) ACHENPC1MEN1KMT2ACALM1
SCHEMBL7195064 0.83 MEN1 (0.52) NPC1LMNAHTTMEN1TSHR
SCHEMBL7190512 0.82 NPC1 (0.44) NPC1LMNAHTTMEN1TSHR
SCHEMBL7193948 0.82 SLC5A1 (0.44) LMNAKMT2A
SCHEMBL7188095 0.81 THRA (0.43)
SCHEMBL7189716 0.81 PPARG (0.42) ACHE
SCHEMBL7197673 0.81 CYP19A1 (0.47) NPC1LMNAHTTMEN1KMT2A
SCHEMBL7193306 0.80 FOS (0.53) LMNAHTTTSHR
SCHEMBL7193969 0.80 PLA2G2A (0.48) NPC1HTTMEN1KMT2A

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 POLB 685/4885ACHE 3599/4885NPC1 3105/4885

“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.