SCHEMBL7196312

SCHEMBL7196312

CCCOc1cccc(C(=O)CCc2cc(CC)ccc2OCCC)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.52
THRA P10827 1/20 0.48
THRB P10828 1/20 0.48
LTB4R Q15722 1/20 0.44
FOS P01100 1/20 0.44
JUN P05412 1/20 0.44
PLA2G4B P0C869 1/20 0.43
NR1H4 Q96RI1 1/20 0.43
PPARG P37231 4/20 0.42
PPARD Q03181 4/20 0.42
SLC5A1 P13866 1/20 0.42
SLC5A2 P31639 1/20 0.42
ADRB2 P07550 1/20 0.42
ADRB1 P08588 1/20 0.42
ADRB3 P13945 1/20 0.42
ABCB1 P08183 1/20 0.42
PPARA Q07869 2/20 0.42
MTNR1A P48039 1/20 0.42
MTNR1B P49286 1/20 0.42
MEN1 O00255 1/20 0.41

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
SCHEMBL7198598 0.94 THRB (0.53) KMT2ATHRATHRBLTB4RFOS
SCHEMBL7193935 0.93 THRA (0.57) KMT2ATHRATHRBLTB4RPLA2G4B
SCHEMBL7198565 0.92 THRA (0.59) KMT2ATHRATHRBLTB4RPLA2G4B
SCHEMBL7189329 0.91 KMT2A (0.57) KMT2ATHRATHRBLTB4RFOS
SCHEMBL7193948 0.90 SLC5A1 (0.44) KMT2ATHRATHRBLTB4RPPARG
SCHEMBL7193490 0.88 FOS (0.46) KMT2ATHRATHRBFOSJUN
SCHEMBL7193665 0.86 THRB (0.58) KMT2ATHRATHRBLTB4RFOS
SCHEMBL7193491 0.84 FOS (0.64) KMT2AFOSJUNNR1H4PPARG
SCHEMBL7193633 0.84 SLC5A1 (0.46) PPARGPPARDSLC5A1SLC5A2ABCB1
SCHEMBL7188095 0.84 THRA (0.43) THRATHRBLTB4RPPARGSLC5A1

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 KMT2A 4485/4885THRA 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.