SCHEMBL13601516

SCHEMBL13601516

CCc1ccc(-c2noc(C)n2)cc1CC

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.59
CA12 O43570 2/20 0.50
CA1 P00915 2/20 0.50
CA2 P00918 2/20 0.50
CA9 Q16790 2/20 0.50
PLK1 P53350 1/20 0.49
RAB9A P51151 5/20 0.48
LMNA P02545 2/20 0.48
TSHR P16473 2/20 0.48
NFKB1 P19838 1/20 0.48
NFKB2 Q00653 1/20 0.48
RELA Q04206 1/20 0.48
MAOA P21397 1/20 0.43
MAOB P27338 1/20 0.43
GSK3B P49841 1/20 0.43
MAPK14 Q16539 1/20 0.43
HTT P42858 2/20 0.42
HPGD P15428 1/20 0.42
MPO P05164 1/20 0.41
NPC1 O15118 4/20 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
SCHEMBL19728838 0.87 L3MBTL1 (0.56) L3MBTL1CA12CA1CA2CA9
SCHEMBL7453298 0.86 L3MBTL1 (0.54) L3MBTL1CA12CA1CA2CA9
SCHEMBL13601513 0.82 L3MBTL1 (0.57) L3MBTL1CA12CA1CA2CA9
SCHEMBL7441070 0.79 PLK1 (0.49) L3MBTL1PLK1RAB9ALMNATSHR
SCHEMBL13415301 0.78 L3MBTL1 (0.69) L3MBTL1CA12CA1CA2CA9
SCHEMBL20486478 0.78 S1PR1 (0.60) L3MBTL1CA12CA1CA2CA9
SCHEMBL8436680 0.77 MAPT (0.61) L3MBTL1CA12CA1CA2CA9
SCHEMBL14810779 0.76 RXRA (0.50) L3MBTL1CA12CA1CA2CA9
SCHEMBL7604286 0.76 L3MBTL1 (0.62) L3MBTL1CA12CA1CA2CA9
SCHEMBL10066488 0.75 L3MBTL1 (0.72) L3MBTL1RAB9ALMNATSHRNPC1

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-20090298894-A1 AMINO ACID COMPOUNDS ASAHI KASEI PHARMA CORPORATION (JP) 2009-12-03 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-20090298894-A1 AMINO ACID COMPOUNDS S1PR1, S1PR2, S1PR5 L3MBTL1 1050/4885CA12 4770/4885CA1 3297/4885

“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.