SCHEMBL24968874

SCHEMBL24968874

Cc1cc2c(cc1N)c(C)nn2C1CCCCO1

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.47
CYP4F2 P78329 2/20 0.39
CYP4A11 Q02928 2/20 0.39
RET P07949 7/20 0.38
ALDH1A1 P00352 1/20 0.36
LMNA P02545 1/20 0.36
POLB P06746 1/20 0.36
PIK3CA P42336 1/20 0.35
ATR Q13535 2/20 0.35
ATAD2 Q6PL18 1/20 0.35
DGAT2 Q96PD7 1/20 0.33
RXRA P19793 1/20 0.32
RXRB P28702 1/20 0.32
RXRG P48443 1/20 0.32
PDE8B O95263 1/20 0.32
PIK3CD O00329 1/20 0.32
PDE7A Q13946 1/20 0.31

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
SCHEMBL1026714 0.95 GAA (0.47) GAACYP4F2CYP4A11RETALDH1A1
SCHEMBL5616695 0.88 GAA (0.42) GAACYP4F2CYP4A11RETALDH1A1
SCHEMBL19286436 0.87 GAA (0.41) GAACYP4F2CYP4A11RETALDH1A1
SCHEMBL1024018 0.82 GAA (0.42) GAACYP4F2CYP4A11RETALDH1A1
SCHEMBL21198529 0.82 GAA (0.47) GAACYP4F2CYP4A11RETALDH1A1
SCHEMBL24610343 0.82 GAA (0.47) GAACYP4F2CYP4A11RETALDH1A1
SCHEMBL29659128 0.82 GAA (0.47) GAACYP4F2CYP4A11RETALDH1A1
SCHEMBL2144073 0.82 GAA (0.47) GAACYP4F2CYP4A11RETALDH1A1
SCHEMBL1025883 0.81 GAA (0.38) GAACYP4F2CYP4A11RETALDH1A1
SCHEMBL18281904 0.80 GAA (0.41) GAACYP4F2CYP4A11RETALDH1A1

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-20230021916-A1 MODULATORS OF RHO-ASSOCIATED PROTEIN KINASE REDX PHARMA LIMITED (GB) 2023-01-26 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-20230021916-A1 MODULATORS OF RHO-ASSOCIATED PROTEIN KINASE ROCK2, ROCK1, RHOA GAA 2236/4885CYP4F2 3606/4885CYP4A11 2418/4885

“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.