SCHEMBL20654283

SCHEMBL20654283

CC(C)O[C@H]1C[C@H](CN2CCOCC2)C1

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ HRH3 Q9Y5N1 2/20 0.38
▸ ALDH1A1 P00352 2/20 0.34
▸ GAA P10253 4/20 0.33
▸ USP2 O75604 1/20 0.33
▸ LRRK2 Q5S007 1/20 0.33
▸ THRB P10828 2/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ SLC6A3 Q01959 1/20 0.31
▸ MAPT P10636 1/20 0.30
▸ LMNA P02545 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
SCHEMBL20654103 0.80 HRH3 (0.41) HRH3ALDH1A1GAAUSP2THRB
SCHEMBL21933937 0.77 — —
SCHEMBL20654101 0.74 CYP2A13 (0.35) ALDH1A1SLC6A3
SCHEMBL20654040 0.74 CYP2A13 (0.35) ALDH1A1SLC6A3
SCHEMBL18727392 0.74 HRH3 (0.44) HRH3ALDH1A1GAAUSP2THRB
SCHEMBL3378090 0.73 HRH3 (0.37) HRH3ALDH1A1GAATHRBKDM4E
SCHEMBL3378092 0.73 HRH3 (0.37) HRH3ALDH1A1GAATHRBKDM4E
SCHEMBL12014128 0.72 HRH3 (0.35) HRH3ALDH1A1GAAUSP2THRB
SCHEMBL20755339 0.72 CHRM5 (0.42) HRH3ALDH1A1THRBMAPT
SCHEMBL21450672 0.71 THRB (0.39) HRH3ALDH1A1GAAUSP2THRB

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-20200291018-A1 TAM KINASE INHIBITORS SYROS PHARMACEUTICALS, INC. (US) 2020-09-17 — — US disclosed
WO-2019014513-A1 TAM KINASE INHIBITORS SYROS PHARMACEUTICALS, INC. (US) 2019-01-17 — — WO 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-20200291018-A1 TAM KINASE INHIBITORS MAP3K1, PIK3CA, MAP3K5 HRH3 2027/4885ALDH1A1 3392/4885GAA 821/4885

“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.

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