SCHEMBL19744560

SCHEMBL19744560

CC(C)(C)OC(=O)N[C@H](CC1CCCCC1)C(=O)N1C[C@H](N=[N+]=[N-])C[C@H]1C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CTSS P25774 2/20 0.48
CTSK P43235 2/20 0.48
MMP2 P08253 1/20 0.41
ANPEP P15144 1/20 0.41
HTRA1 Q92743 2/20 0.37
ACE P12821 1/20 0.37
AAK1 Q2M2I8 1/20 0.36
HDAC4 P56524 1/20 0.36
HDAC1 Q13547 1/20 0.36
HDAC6 Q9UBN7 1/20 0.36
ITGB3 P05106 7/20 0.35
ITGA2B P08514 7/20 0.35
REN P00797 2/20 0.35
CACNA1B Q00975 1/20 0.34

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
SCHEMBL19745167 1.00 CTSS (0.48) CTSSCTSKMMP2ANPEPHTRA1
SCHEMBL19744563 1.00 CTSS (0.48) CTSSCTSKMMP2ANPEPHTRA1
SCHEMBL19745166 1.00 CTSS (0.48) CTSSCTSKMMP2ANPEPHTRA1
SCHEMBL21536101 1.00 CTSS (0.48) CTSSCTSKMMP2ANPEPHTRA1
SCHEMBL29458800 0.92 MMP2 (0.53) CTSSCTSKMMP2ANPEPHTRA1
SCHEMBL28979548 0.92 MMP2 (0.53) CTSSCTSKMMP2ANPEPHTRA1
SCHEMBL21119318 0.92 MMP2 (0.53) CTSSCTSKMMP2ANPEPHTRA1
SCHEMBL29398426 0.92 MMP2 (0.53) CTSSCTSKMMP2ANPEPHTRA1
SCHEMBL19747959 0.84 CTSS (0.53) CTSSCTSKHTRA1ACEAAK1
SCHEMBL21488665 0.84 CTSS (0.53) CTSSCTSKHTRA1ACEAAK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3472130-B1 ALIPHATIC PROLINAMIDE DERIVATIVES Orion Ophthalmology LLC (US) 2022-02-16 EP disclosed
US-10730832-B2 Aliphatic prolinamide derivatives Orion Ophthalmology LLC (US) 2020-08-04 US disclosed
US-20190330146-A1 ALIPHATIC PROLINAMIDE DERIVATIVES Orion Ophthalmology LLC (US) 2019-10-31 US disclosed
EP-3472130-A1 ALIPHATIC PROLINAMIDE DERIVATIVES ORION OPTHALMOLOGY LLC (US) 2019-04-24 EP disclosed
WO-2017222917-A1 ALIPHATIC PROLINAMIDE DERIVATIVES INCEPTION 4, INC. (US) 2017-12-28 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 (2 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-10730832-B2 Aliphatic prolinamide derivatives HTRA1, ALDH1A2, PREP CTSS 746/4885CTSK 1449/4885MMP2 145/4885
US-20190330146-A1 ALIPHATIC PROLINAMIDE DERIVATIVES HTRA1, ALDH1A2, PREP CTSS 746/4885CTSK 1449/4885MMP2 145/4885

“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.