SCHEMBL2184049

SCHEMBL2184049

CC(C)C[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)N)C(=O)N[C@H]([C]=O)C(C)C

nearest known ligand 0.58

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ERAP2 Q6P179 9/20 0.58
IL1RN P18510 9/20 0.57
ECE1 P42892 6/20 0.56
ERAP1 Q9NZ08 3/20 0.55
MMP2 P08253 4/20 0.55
MMP1 P03956 2/20 0.55
MMP9 P14780 2/20 0.55
MMP8 P22894 2/20 0.55

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
SCHEMBL28081225 0.91 ECE1 (0.56) ERAP2ECE1MMP2MMP1MMP9
SCHEMBL30051783 0.86 ECE1 (0.70) ERAP2IL1RNECE1ERAP1MMP2
SCHEMBL4959976 0.86 ERAP2 (0.75) ERAP2IL1RNECE1ERAP1
SCHEMBL4959992 0.86 ERAP2 (0.75) ERAP2IL1RNECE1ERAP1
SCHEMBL9822631 0.86 ECE1 (0.70) ERAP2IL1RNECE1ERAP1MMP2
SCHEMBL29380143 0.84 ERAP2 (0.69) ERAP2IL1RNECE1ERAP1
SCHEMBL29380319 0.84 ERAP2 (0.64) ERAP2IL1RNECE1ERAP1MMP2
SCHEMBL2192238 0.83 KISS1R (0.57) ERAP2IL1RNECE1ERAP1MMP2
SCHEMBL3979342 0.82 ERAP2 (0.62) ERAP2IL1RNECE1ERAP1MMP2
SCHEMBL30051087 0.82 ACE (0.75) ERAP2ECE1

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-20110166063-A1 POLYMER CONJUGATES OF THERAPEUTIC PEPTIDES NEKTAR THERAPEUTICS (US) 2011-07-07 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-20110166063-A1 POLYMER CONJUGATES OF THERAPEUTIC PEPTIDES NGLY1, CD44, IAPP ERAP2 638/4885IL1RN 546/4885ECE1 1503/4885

“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.