SCHEMBL535102

SCHEMBL535102

COCCCc1cccc(C)c1-c1ccc(C2CN(C(=O)O)CCC2c2cccnc2)c(C)c1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
REN P00797 2/20 0.36
KCNH2 Q12809 1/20 0.36
KDM4C Q9H3R0 2/20 0.34
MEN1 O00255 1/20 0.34
CYP3A4 P08684 1/20 0.34
KMT2A Q03164 1/20 0.34
CRHBP P24387 1/20 0.33
CRHR2 Q13324 1/20 0.33
APLNR P35414 1/20 0.32
KDM4E B2RXH2 2/20 0.32
ALDH1A1 P00352 1/20 0.32
GLA P06280 1/20 0.32
GAA P10253 1/20 0.32
HPGD P15428 1/20 0.32
CASP1 P29466 1/20 0.32
CASP7 P55210 1/20 0.32
HSD17B10 Q99714 1/20 0.32
NAMPT P43490 1/20 0.32
CHRM4 P08173 1/20 0.32
SPR P35270 1/20 0.32

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
SCHEMBL556315 0.85 REN (0.40) RENKCNH2MEN1CYP3A4KMT2A
SCHEMBL556180 0.84 REN (0.38) RENMEN1CYP3A4KMT2AAPLNR
SCHEMBL534916 0.82 REN (0.54) RENKCNH2KDM4CCYP3A4APLNR
SCHEMBL557570 0.81 REN (0.43) RENKCNH2APLNRKDM4EHSD17B10
SCHEMBL7869555 0.81 REN (0.49) RENKCNH2CYP3A4KDM4EALDH1A1
SCHEMBL555467 0.78 REN (0.61) RENKCNH2KDM4CCYP3A4NAMPT
SCHEMBL556668 0.77 LIPE (0.36) RENKCNH2CYP3A4LIPE
SCHEMBL534491 0.76 SPR (0.37) KDM4EALDH1A1NAMPTCHRM4SPR
SCHEMBL534289 0.75 REN (0.41) RENKCNH2APLNR
SCHEMBL557571 0.73 REN (0.41) RENKCNH2KDM4CMEN1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120035214-A1 RENIN INHIBITORS MERCK CANADA INC. (CA) 2012-02-09 US disclosed
EP-2413941-A1 RENIN INHIBITORS Merck Sharp & Dohme Corp. (US) 2012-02-08 EP disclosed
WO-2010114978-A1 RENIN INHIBITORS MERCK SHARP & DOHME CORP. (US) 2010-10-07 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-20120035214-A1 RENIN INHIBITORS REN, ACE, AGTR1 REN 1/4885KCNH2 1198/4885KDM4C 2504/4885

“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.