SCHEMBL8256405

SCHEMBL8256405

COC(=O)[C@H](Cc1cc[nH]n1)N[C@@H](CC(C)C)C(=O)OCc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ANPEP P15144 1/20 0.48
S1PR4 O95977 2/20 0.46
S1PR1 P21453 1/20 0.46
MAPT P10636 4/20 0.45
CTSK P43235 2/20 0.45
ALDH1A1 P00352 2/20 0.44
NTSR1 P30989 1/20 0.44
ATM Q13315 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
RECQL P46063 1/20 0.44
CAPN1 P07384 1/20 0.44
BIRC2 Q13490 1/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
GAA P10253 1/20 0.43
TAAR1 Q96RJ0 1/20 0.43

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
SCHEMBL5869581 1.00 ANPEP (0.48) ANPEPS1PR4S1PR1MAPTCTSK
SCHEMBL10421048 0.82 CTSK (0.60) S1PR4S1PR1MAPTCTSK
SCHEMBL8248870 0.82 ANPEP (0.55) ANPEPCAPN1BIRC2
SCHEMBL8437490 0.81 TAS1R3 (0.42) ANPEPALDH1A1NPSR1BIRC2
SCHEMBL7480048 0.81 ANPEP (0.45) ANPEPS1PR4S1PR1MAPTCTSK
SCHEMBL5870299 0.81 RAB9A (0.46) ANPEPMAPTCTSKALDH1A1ATM
SCHEMBL5869967 0.81 ANPEP (0.45) ANPEPS1PR4S1PR1MAPTCTSK
SCHEMBL5869690 0.80 ANPEP (0.50) ANPEPCTSKCAPN1BIRC2
SCHEMBL5869470 0.80 ANPEP (0.50) ANPEPCTSKCAPN1BIRC2
SCHEMBL5869462 0.80 ANPEP (0.50) ANPEPCTSKCAPN1BIRC2

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-20040082496-A1 ACE-2 modulating compounds and methods of use thereof MILLENNIUM PHARMACEUTICALS, INC. 2004-04-29 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-20040082496-A1 ACE-2 modulating compounds and methods of use thereof ACE, ACE2, AGTR2 ANPEP 118/4885S1PR4 2291/4885S1PR1 2262/4885

“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.