SCHEMBL3103641

SCHEMBL3103641

CC(=O)N(C)Cc1ccc(Cl)c(CN(C(=O)C2CN(C(=O)OC(C)(C)C)CCC2=O)C2CC2)c1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
REN P00797 3/20 0.41
GPR119 Q8TDV5 4/20 0.38
JAK2 O60674 1/20 0.38
JAK1 P23458 1/20 0.38
NR1D1 P20393 2/20 0.38
TACR1 P25103 1/20 0.36
KCNH2 Q12809 1/20 0.35
TP53 P04637 1/20 0.35
PTPRB P23467 1/20 0.34
PTPN11 Q06124 1/20 0.34
PARP1 P09874 1/20 0.34
PARP2 Q9UGN5 1/20 0.34
BIRC5 O15392 1/20 0.34
DDB1 Q16531 1/20 0.34
CRBN Q96SW2 1/20 0.34
USP30 Q70CQ3 1/20 0.34

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
SCHEMBL3414839 0.88 REN (0.42) RENTACR1KCNH2USP30
SCHEMBL1229339 0.87 REN (0.46) RENKCNH2
SCHEMBL3108333 0.86 REN (0.48) RENKCNH2
SCHEMBL3111265 0.81 REN (0.52) RENJAK2JAK1KCNH2
SCHEMBL4155087 0.77 JAK2 (0.40) RENGPR119JAK2JAK1KCNH2
SCHEMBL3096976 0.77 REN (0.45) RENKCNH2
SCHEMBL1071703 0.76 REN (0.48) RENKCNH2
SCHEMBL3417760 0.75 REN (0.51) RENKCNH2
SCHEMBL12243834 0.73 DDB1 (0.46) GPR119JAK2JAK1DDB1CRBN
SCHEMBL13538347 0.72 REN (0.46) RENKCNH2

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100249163-A1 RENIN INHIBITORS MERCK CANADA INC. (CA) 2010-09-30 US disclosed
US-20100249163-A1 RENIN INHIBITORS MERCK CANADA INC. (CA) 2010-09-30 US disclosed
US-20100249163-A1 RENIN INHIBITORS MERCK CANADA INC. (CA) 2010-09-30 US disclosed
WO-2009070869-A1 RENIN INHIBITORS MERCK FROSST CANADA LTD. (CA) 2009-06-11 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-20100249163-A1 RENIN INHIBITORS REN, ACE, AGTR1 REN 1/4885GPR119 435/4885JAK2 3497/4885

“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.