SCHEMBL5869128

SCHEMBL5869128

CC(C)C[C@H](NC(Cc1cccc(-c2ccsc2)c1)C(=O)O)C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 2/20 0.49
PRMT6 Q96LA8 1/20 0.49
MMP2 P08253 1/20 0.45
MMP3 P08254 1/20 0.45
MME P08473 4/20 0.44
ACE P12821 2/20 0.44
CPA1 P15085 1/20 0.44
ACE2 Q9BYF1 1/20 0.44
CTSK P43235 2/20 0.43
CTSL P07711 1/20 0.43
CTSB P07858 1/20 0.43
CTSS P25774 1/20 0.43
HTR1A P08908 1/20 0.43
ERAP2 Q6P179 1/20 0.41
ERAP1 Q9NZ08 1/20 0.41
LNPEP Q9UIQ6 1/20 0.41
ECE1 P42892 1/20 0.41

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
SCHEMBL5869139 1.00 FOLH1 (0.49) FOLH1PRMT6MMP2MMP3MME
SCHEMBL5869134 1.00 FOLH1 (0.49) FOLH1PRMT6MMP2MMP3MME
SCHEMBL5869466 0.87 MME (0.50) FOLH1MMEACECPA1ACE2
SCHEMBL7599743 0.87 MME (0.50) FOLH1MMEACECPA1ACE2
SCHEMBL5869476 0.87 MME (0.50) FOLH1MMEACECPA1ACE2
SCHEMBL5869455 0.87 MME (0.50) FOLH1MMEACECPA1ACE2
SCHEMBL5869962 0.82 ANPEP (0.44) PRMT6CTSKCTSLCTSSHTR1A
SCHEMBL5869969 0.82 ANPEP (0.44) PRMT6CTSKCTSLCTSSHTR1A
SCHEMBL5869964 0.82 ANPEP (0.44) PRMT6CTSKCTSLCTSSHTR1A
SCHEMBL5869080 0.82 FOLH1 (0.52) FOLH1MMEACECPA1ACE2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7045532-B2 ACE-2 modulating compounds and methods of use thereof MILLENNIUM PHARMACEUTICALS, INC. (US) 2006-05-16 US disclosed
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 FOLH1 229/4885PRMT6 1109/4885MMP2 266/4885

“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.