SCHEMBL4841326

SCHEMBL4841326

CC(C)=CCC/C(C)=C/CC/C(C)=C/CC/C(C)=C/C=C/C=C(\C)C/C=C/C(C)=C/C=C/C(C)CCC=C(C)C

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NR1I2 O75469 1/20 0.54
LMNA P02545 1/20 0.54
PGR P06401 1/20 0.54
FNTA P49354 2/20 0.40
FNTB P49356 2/20 0.40
KMT2A Q03164 3/20 0.38
ALDH1A1 P00352 3/20 0.36
MAPT P10636 2/20 0.36
MEN1 O00255 2/20 0.36
CYP3A4 P08684 1/20 0.36
ALOX15 P16050 1/20 0.36
UGT1A1 P22309 1/20 0.36
SQLE Q14534 2/20 0.35
RECQL P46063 1/20 0.34

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
SCHEMBL5078672 0.90 NR1I2 (0.61) NR1I2LMNAPGRFNTAFNTB
SCHEMBL6315751 0.84 NR1I2 (0.46) NR1I2LMNAPGRFNTAFNTB
SCHEMBL4847430 0.84 NR1I2 (0.53) NR1I2LMNAPGRFNTAFNTB
SCHEMBL18887568 0.84 NR1I2 (0.53) NR1I2LMNAPGRFNTAFNTB
SCHEMBL5596890 0.81 NR1I2 (0.66) NR1I2LMNAPGRFNTAFNTB
SCHEMBL5614182 0.81 NR1I2 (0.49) NR1I2LMNAPGRFNTAFNTB
SCHEMBL5201689 0.76 LSS (0.56)
SCHEMBL2837840 0.75 NR1I2 (0.93) NR1I2LMNAPGRFNTAFNTB
SCHEMBL323577 0.75 NR1I2 (0.93) NR1I2LMNAPGRFNTAFNTB
SCHEMBL2836986 0.75 NR1I2 (0.93) NR1I2LMNAPGRFNTAFNTB

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-7375133-B2 Pharmaceutical compositions including carotenoid ether analogs or derivatives for the inhibition and amelioration of disease CARDAX PHARMACEUTICALS, INC. (US) 2008-05-20 US disclosed
US-20050065096-A1 Pharmaceutical compositions including carotenoid ether analogs or derivatives for the inhibition and amelioration of disease CARDAX PHARMA, INC. 2005-03-24 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-20050065096-A1 Pharmaceutical compositions including carotenoid ether analogs or derivatives for the inhibition and amelioration of disease CYP11B2, CYP11B1, PTGER1 NR1I2 635/4885LMNA 969/4885PGR 1648/4885

“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.