SCHEMBL24920359

SCHEMBL24920359

CC(C)(C)OC(=O)n1cc(B2CC(C)(C)C(C)(C)O2)cn1

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ROCK2 O75116 1/20 0.36
SCD O00767 1/20 0.36
NR1H2 P55055 1/20 0.35
USP30 Q70CQ3 2/20 0.35
FFAR1 O14842 1/20 0.34
GPR119 Q8TDV5 2/20 0.31
BACE1 P56817 1/20 0.31
BACE2 Q9Y5Z0 1/20 0.31
RET P07949 1/20 0.30
ELANE P08246 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
SCHEMBL23360896 0.81 FFAR1 (0.40) ROCK2SCDNR1H2USP30FFAR1
SCHEMBL141413 0.81 FFAR1 (0.52) ROCK2SCDNR1H2USP30FFAR1
SCHEMBL722900 0.81 ROCK2 (0.39) ROCK2SCDNR1H2USP30GPR119
SCHEMBL13006087 0.76 FFAR1 (0.36) FFAR1
SCHEMBL23349424 0.76 SCD (0.38) ROCK2SCDNR1H2USP30FFAR1
SCHEMBL25826104 0.76 FFAR1 (0.44) ROCK2SCDNR1H2USP30FFAR1
SCHEMBL19341509 0.76 FFAR1 (0.44) ROCK2SCDNR1H2USP30FFAR1
SCHEMBL19964091 0.75 FFAR1 (0.40) ROCK2SCDNR1H2USP30FFAR1
SCHEMBL20922047 0.74 FFAR1 (0.35) FFAR1
SCHEMBL20733996 0.74 FFAR1 (0.45) ROCK2SCDNR1H2USP30FFAR1

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-20230030720-A1 CYCLOALKANE-1,3-DIAMINE DERIVATIVE DAIICHI SANKYO COMPANY, LIMITED (JP) 2023-02-02 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-20230030720-A1 CYCLOALKANE-1,3-DIAMINE DERIVATIVE MLLT1, MEN1, MLLT3 ROCK2 3506/4885SCD 3453/4885NR1H2 1753/4885

“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.