SCHEMBL23153641

SCHEMBL23153641

CC(C)c1cc(N)c(C(C)C)c(C(C)C)c1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 1/20 0.43
GABRB2 P47870 1/20 0.43
FABP4 P15090 3/20 0.42
FABP3 P05413 2/20 0.42
GAA P10253 2/20 0.42
ALDH1A1 P00352 1/20 0.42
ALOX12 P18054 1/20 0.42
HTT P42858 1/20 0.42
HIF1A Q16665 1/20 0.42
FABP5 Q01469 1/20 0.41
POLB P06746 1/20 0.33
GFER P55789 1/20 0.33
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30

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
SCHEMBL29199950 0.85 ALDH1A1 (0.48) GABRA1GABRB2FABP4FABP3GAA
SCHEMBL9064395 0.83 GABRA1 (0.52) GABRA1GABRB2FABP4FABP3GAA
SCHEMBL27889312 0.79 GABRA1 (0.45) GABRA1GABRB2FABP4FABP3GAA
SCHEMBL26521897 0.76 GABRA1 (0.63) GABRA1GABRB2FABP4FABP3GAA
SCHEMBL3440745 0.75 GABRA1 (0.50) GABRA1GABRB2FABP4FABP3GAA
SCHEMBL8976031 0.74 GAA (0.38) GAAALDH1A1ALOX12HTTHIF1A
SCHEMBL840954 0.74 DHFR (0.41) GAAALDH1A1POLBGFER
SCHEMBL27439431 0.73 GABRA1 (0.65) GABRA1GABRB2FABP4FABP3GAA
SCHEMBL18380019 0.73 GABRA1 (0.48) GABRA1GABRB2FABP4FABP3FABP5
SCHEMBL10334357 0.72 GAA (0.42) GABRA1GABRB2FABP4FABP3GAA

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-10960036-B2 Pharmaceutical composition for preventing and treating alpha herpes virus infection, containing, as active ingredient, Elaeocarpus sylvestris extract or fraction thereof GENENCELL CO., LTD. (KR) 2021-03-30 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-10960036-B2 Pharmaceutical composition for preventing and treating alpha herpes virus infection, containing, as active ingredient, Elaeocarpus sylvestris extract or fraction thereof ACHE, EPHA3, EPHA1 GABRA1 2466/4885GABRB2 2920/4885FABP4 4679/4885

“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.