SCHEMBL2325946

SCHEMBL2325946

CC([C]=O)C1COc2ccccc2O1

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.54
MAPT P10636 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
NPSR1 Q6W5P4 1/20 0.54
ALDH1A1 P00352 4/20 0.52
KDM4E B2RXH2 2/20 0.48
POLB P06746 2/20 0.48
GAA P10253 1/20 0.48
KMT2A Q03164 2/20 0.43
NPC1 O15118 1/20 0.41
MTNR1A P48039 1/20 0.40
HPGD P15428 1/20 0.40
LTA4H P09960 1/20 0.40
NISCH Q9Y2I1 1/20 0.39

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
SCHEMBL1568390 0.81 LMNA (0.57) LMNAMAPTSMN1; SMN2NPSR1ALDH1A1
SCHEMBL12340 0.80 LMNA (0.56) LMNAMAPTSMN1; SMN2NPSR1ALDH1A1
SCHEMBL13676827 0.80 LMNA (0.56) LMNAMAPTSMN1; SMN2NPSR1ALDH1A1
SCHEMBL13533398 0.80 LMNA (0.56) LMNAMAPTSMN1; SMN2NPSR1ALDH1A1
SCHEMBL6636679 0.77 LMNA (0.54) LMNAMAPTSMN1; SMN2NPSR1ALDH1A1
SCHEMBL10832911 0.77 LMNA (0.57) LMNAMAPTSMN1; SMN2NPSR1ALDH1A1
SCHEMBL4461156 0.77 LMNA (0.54) LMNAMAPTSMN1; SMN2NPSR1ALDH1A1
SCHEMBL27852026 0.77 LMNA (0.61) LMNAMAPTSMN1; SMN2NPSR1ALDH1A1
SCHEMBL27531571 0.76 LMNA (0.50) LMNAMAPTSMN1; SMN2NPSR1ALDH1A1
SCHEMBL4553264 0.75 LMNA (0.59) LMNAMAPTSMN1; SMN2NPSR1ALDH1A1

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-20110251393-A1 HELICENE DERIVATIVE, AXIALLY ASYMMETRIC AMINO ACID, AMINE OR AMINOALCOHOL DERIVATIVE, PERYLENE DERIVATIVE OR SALT THEREOF, AND METHODS FOR PRODUCING SAME KYOTO UNIVERSITY (JP) 2011-10-13 US disclosed
EP-2357177-A1 HELICENE DERIVATIVE, AXIALLY ASYMMETRIC AMINO ACID, AMINE OR AMINOALCOHOL DERIVATIVE, PERYLENE DERIVATIVE OR SALT THEREOF, AND METHODS FOR PRODUCING SAME Kyoto University (JP) 2011-08-17 EP 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-20110251393-A1 HELICENE DERIVATIVE, AXIALLY ASYMMETRIC AMINO ACID, AMINE OR AMINOALCOHOL DERIVATIVE, PERYLENE DERIVATIVE OR SALT THEREOF, AND METHODS FOR PRODUCING SAME AADAT, AASDHPPT, AZI2 LMNA 3021/4885MAPT 1818/4885SMN1; SMN2 3613/4885

“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.