SCHEMBL886038

SCHEMBL886038

COCCOc1ccccc1-n1c(-c2ccccc2)c(C(=O)N2CCN(C(=O)O)CC2)[nH]c1=O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
REN P00797 1/20 0.42
POLB P06746 2/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
CYP3A4 P08684 1/20 0.38
CYP2C9 P11712 1/20 0.38
PKM P14618 1/20 0.38
CYP2C19 P33261 1/20 0.38
AVPR2 P30518 2/20 0.38
AVPR1A P37288 2/20 0.38
HIF1A Q16665 2/20 0.38
LMNA P02545 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
MAPT P10636 2/20 0.37
USP2 O75604 1/20 0.37
HSP90AA1 P07900 1/20 0.37
HTT P42858 1/20 0.37
HPGDS O60760 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
TACR2 P21452 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
SCHEMBL885725 0.95 REN (0.47) RENPOLBMEN1KMT2ACYP3A4
SCHEMBL2062523 0.91 REN (0.51) RENMEN1KMT2ACYP2C9AVPR2
SCHEMBL8171275 0.89 MEN1 (0.41) RENPOLBMEN1KMT2AMAPT
SCHEMBL2062794 0.87 REN (0.56) RENMEN1KMT2ACYP2C9AVPR2
SCHEMBL885838 0.86 NTRK1 (0.40) RENMEN1KMT2ASMN1; SMN2MAPT
SCHEMBL8164725 0.85 REN (0.43) RENPOLBMEN1KMT2AMAPT
SCHEMBL885512 0.84 REN (0.45) RENCYP3A4SMN1; SMN2USP2NTRK1
SCHEMBL885791 0.83 LMNA (0.43) POLBCYP3A4CYP2C9CYP2C19LMNA
SCHEMBL885836 0.81 REN (0.42) RENMEN1KMT2AAVPR2AVPR1A
SCHEMBL885859 0.79 REN (0.50) RENCYP3A4SMN1; SMN2MAPTUSP2

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
WO-2008089005-A2 RENIN INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-07-24 WO claimed
US-8148367-B2 Renin inhibitors TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-04-03 US disclosed
US-20100105665-A1 RENIN INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-04-29 US disclosed
WO-2008089005-A2 RENIN INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-07-24 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-20100105665-A1 RENIN INHIBITORS REN, ACE, AGT REN 1/4885POLB 1491/4885MEN1 1487/4885

“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.