SCHEMBL4180280

SCHEMBL4180280

CCCCCCOc1ccc(C(=O)Oc2cccc(CCCCC)c2)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 4/20 0.58
NPC1 O15118 3/20 0.58
LMNA P02545 3/20 0.58
PPARG P37231 3/20 0.58
NFKB1 P19838 3/20 0.58
NFKB2 Q00653 3/20 0.58
RELA Q04206 3/20 0.58
SMN1; SMN2 Q16637 2/20 0.58
CYP2D6 P10635 2/20 0.56
CYP1A2 P05177 1/20 0.56
CYP3A4 P08684 1/20 0.56
CYP2C9 P11712 1/20 0.56
CYP2C19 P33261 1/20 0.56
KMT2A Q03164 2/20 0.56
CNR1 P21554 1/20 0.55
CNR2 P34972 1/20 0.55
PLA2G4B P0C869 3/20 0.55
MAPT P10636 2/20 0.54
POLB P06746 1/20 0.54
TP53 P04637 1/20 0.53

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
SCHEMBL4179938 0.90 PPARA (0.62) PPARAPPARGCYP2D6KMT2ACNR1
SCHEMBL13309866 0.90 NPC1 (0.67) NPC1LMNANFKB1NFKB2RELA
SCHEMBL13309867 0.90 NPC1 (0.67) NPC1LMNANFKB1NFKB2RELA
SCHEMBL303090 0.89 LMNA (0.69) NPC1LMNANFKB1NFKB2RELA
SCHEMBL13038199 0.89 LMNA (0.69) NPC1LMNANFKB1NFKB2RELA
SCHEMBL302600 0.89 LMNA (0.69) NPC1LMNANFKB1NFKB2RELA
SCHEMBL10807628 0.87 PPARA (0.64) PPARAPPARGCNR1CNR2
SCHEMBL13038204 0.86 RARB (0.64) NPC1LMNANFKB1NFKB2RELA
SCHEMBL9855583 0.86 LMNA (0.69) NPC1LMNANFKB1NFKB2RELA
SCHEMBL21124189 0.86 LMNA (0.69) NPC1LMNANFKB1NFKB2RELA

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090143609-A1 LIQUID CRYSTAL COMPOSITIONS AND THEIR USE IN LIQUID CRYSTAL DEVICES IPS ALPHA SUPPORT CO., LTD. (JP) 2009-06-04 US disclosed
US-20090143609-A1 LIQUID CRYSTAL COMPOSITIONS AND THEIR USE IN LIQUID CRYSTAL DEVICES IPS ALPHA SUPPORT CO., LTD. (JP) 2009-06-04 US disclosed

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-20090143609-A1 LIQUID CRYSTAL COMPOSITIONS AND THEIR USE IN LIQUID CRYSTAL DEVICES GTF3C3, CCR3, OR10J3 PPARA 4802/4885NPC1 2125/4885LMNA 2090/4885

“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.