SCHEMBL9946079

SCHEMBL9946079

CB(C)c1ccccc1OCc1ccc(C)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LIPE Q05469 1/20 0.57
SMN1; SMN2 Q16637 3/20 0.51
ALDH1A1 P00352 3/20 0.51
KMT2A Q03164 2/20 0.51
MAPT P10636 4/20 0.49
L3MBTL1 Q9Y468 2/20 0.49
MAPK1 P28482 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
CARM1 Q86X55 2/20 0.46
PRMT1 Q99873 2/20 0.46
HTR1A P08908 1/20 0.46
ADRA1D P25100 1/20 0.46
ADRA1A P35348 1/20 0.46
ADRA1B P35368 1/20 0.46
MEN1 O00255 1/20 0.45
ENPP2 Q13822 1/20 0.44
APP P05067 3/20 0.44
RXRA P19793 1/20 0.43
RXRB P28702 1/20 0.43
RXRG P48443 1/20 0.43

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
SCHEMBL9946050 0.87 LIPE (0.73) LIPESMN1; SMN2MAPTL3MBTL1MAPK1
SCHEMBL2559341 0.86 LIPE (0.77) LIPESMN1; SMN2ALDH1A1KMT2AMAPT
SCHEMBL9946048 0.86 LIPE (0.57) LIPESMN1; SMN2ALDH1A1KMT2AMAPT
SCHEMBL7606605 0.78 RXRA (0.65) LIPESMN1; SMN2ALDH1A1KMT2AMAPT
SCHEMBL31556121 0.75 APP (0.54) LIPESMN1; SMN2ALDH1A1KMT2AMAPT
SCHEMBL12908047 0.75 MAPT (0.52) SMN1; SMN2ALDH1A1KMT2AMAPTL3MBTL1
SCHEMBL11083620 0.75 MAPT (0.52) LIPESMN1; SMN2ALDH1A1KMT2AMAPT
SCHEMBL31556117 0.75 HPGD (0.61) SMN1; SMN2ALDH1A1KMT2AMAPTL3MBTL1
SCHEMBL11091137 0.75 APP (0.69) SMN1; SMN2ALDH1A1KMT2AMAPTL3MBTL1
SCHEMBL28931748 0.75 MAPT (0.52) LIPESMN1; SMN2ALDH1A1KMT2AMAPT

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-20120149693-A1 THERAPEUTIC COMPOUNDS UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) 2012-06-14 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-20120149693-A1 THERAPEUTIC COMPOUNDS HTR2C, GRK2, GRK3 LIPE 3056/4885SMN1; SMN2 3273/4885ALDH1A1 4010/4885

“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.