SCHEMBL556192

SCHEMBL556192

Cc1cc(-c2ccccc2CCNC(=O)OCc2ccccc2)ccc1C1CN(C(=O)OC(C)(C)C)CCC1=O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABCB1 P08183 1/20 0.39
KEAP1 Q14145 1/20 0.39
NFE2L2 Q16236 1/20 0.39
REN P00797 2/20 0.38
KCNH2 Q12809 2/20 0.38
TPSAB1 Q15661 2/20 0.38
TPSD1 Q9BZJ3 2/20 0.38
TPSG1 Q9NRR2 2/20 0.38
PARP1 P09874 1/20 0.37
GPR119 Q8TDV5 1/20 0.37
CD274 Q9NZQ7 2/20 0.37
GHSR Q92847 4/20 0.37
L3MBTL1 Q9Y468 1/20 0.36
ITGB3 P05106 1/20 0.36
ITGA2B P08514 1/20 0.36
LMNA P02545 1/20 0.36
TP53 P04637 1/20 0.36
POLB P06746 1/20 0.36
MAPT P10636 1/20 0.36
USP30 Q70CQ3 1/20 0.36

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
SCHEMBL557035 0.89 REN (0.43) RENKCNH2CD274USP30
SCHEMBL533911 0.80 REN (0.48) RENKCNH2CD274L3MBTL1ENPP2
SCHEMBL556382 0.79 REN (0.39) KEAP1NFE2L2RENKCNH2CD274
SCHEMBL533903 0.79 REN (0.46) RENKCNH2CD274
SCHEMBL556137 0.76 REN (0.62) ABCB1KEAP1NFE2L2RENKCNH2
SCHEMBL557260 0.73 ESR2 (0.51) GPR119MAPTUSP30
SCHEMBL5161957 0.73 GPR119 (0.43) GPR119USP30
SCHEMBL30783165 0.73 GPR119 (0.43) GPR119USP30
SCHEMBL15293404 0.72 CTSK (0.49) PARP1GPR119USP30
SCHEMBL28698221 0.71 NAMPT (0.52) ABCB1

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-20120035214-A1 RENIN INHIBITORS MERCK CANADA INC. (CA) 2012-02-09 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-20120035214-A1 RENIN INHIBITORS REN, ACE, AGTR1 ABCB1 96/4885KEAP1 195/4885NFE2L2 1284/4885

“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.