SCHEMBL19744962

SCHEMBL19744962

COC(=O)C(C)(CC1CCCCC1)NC(=O)OC(C)(C)C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 2/20 0.43
CTSS P25774 2/20 0.42
CTSK P43235 2/20 0.42
GAA P10253 1/20 0.41
DGAT1 O75907 1/20 0.37
CNR1 P21554 1/20 0.37
CNR2 P34972 1/20 0.37
BTK Q06187 1/20 0.36
KMT2A Q03164 2/20 0.36
ALDH1A1 P00352 2/20 0.36
AAK1 Q2M2I8 1/20 0.36
HDAC4 P56524 1/20 0.36
HDAC1 Q13547 1/20 0.36
HDAC6 Q9UBN7 1/20 0.36
MMP1 P03956 1/20 0.36
MMP9 P14780 1/20 0.36
MMP13 P45452 1/20 0.36
ADAM17 P78536 1/20 0.36
CACNA1B Q00975 1/20 0.35
CA12 O43570 2/20 0.35

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
SCHEMBL3612229 0.88 CTSS (0.48) EPHX1CTSSCTSKGAABTK
SCHEMBL3612235 0.88 CTSS (0.48) EPHX1CTSSCTSKGAABTK
SCHEMBL3610835 0.87 EPHX1 (0.43) EPHX1CTSSCTSKGAACNR2
SCHEMBL3610831 0.87 EPHX1 (0.43) EPHX1CTSSCTSKGAACNR2
SCHEMBL3619406 0.78 EPHX1 (0.43) EPHX1CTSSCTSKGAABTK
SCHEMBL3619402 0.78 EPHX1 (0.43) EPHX1CTSSCTSKGAABTK
SCHEMBL5351400 0.77 KMT2A (0.37) EPHX1CTSSCTSKGAAKMT2A
SCHEMBL17771895 0.77 CTSK (0.37) EPHX1CTSSCTSKGAACNR2
SCHEMBL3039514 0.75 EPHX1 (0.41) EPHX1CTSSCTSKGAABTK
SCHEMBL5351874 0.75 GAA (0.45) EPHX1CTSKGAAHDAC4HDAC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11866422-B2 Carbocyclic prolinamide derivatives Orion Ophthalmology LLC (US) 2024-01-09 US disclosed
US-11267803-B2 Carbocyclic prolinamide derivatives Orion Ophthalmology LLC (US) 2022-03-08 US disclosed
US-20210347762-A1 CARBOCYCLIC PROLINAMIDE DERIVATIVES Orion Ophthalmology LLC (US) 2021-11-11 US disclosed
US-20210347762-A1 CARBOCYCLIC PROLINAMIDE DERIVATIVES Orion Ophthalmology LLC (US) 2021-11-11 US disclosed
US-11091465-B2 2021-08-17 US disclosed
US-11091465-B2 2021-08-17 US disclosed
US-20200385362-A1 CARBOCYCLIC PROLINAMIDE DERIVATIVES Orion Ophthalmology LLC (US) 2020-12-10 US disclosed
US-20200385362-A1 CARBOCYCLIC PROLINAMIDE DERIVATIVES Orion Ophthalmology LLC (US) 2020-12-10 US disclosed
US-20190202810-A1 CARBOCYCLIC PROLINAMIDE DERIVATIVES Orion Ophthalmology LLC (US) 2019-07-04 US disclosed
US-20190202810-A1 CARBOCYCLIC PROLINAMIDE DERIVATIVES Orion Ophthalmology LLC (US) 2019-07-04 US disclosed
EP-3472151-A1 CARBOCYCLIC PROLINAMIDE DERIVATIVES ORION OPTHALMOLOGY LLC (US) 2019-04-24 EP disclosed
WO-2017222914-A1 CARBOCYCLIC 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 (6 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-20190202810-A1 CARBOCYCLIC PROLINAMIDE DERIVATIVES HTRA1, ADCYAP1R1, HTRA2 EPHX1 2203/4885CTSS 402/4885CTSK 983/4885
US-11267803-B2 Carbocyclic prolinamide derivatives HTRA1, ADCYAP1R1, HTRA2 EPHX1 2203/4885CTSS 402/4885CTSK 983/4885
US-20200385362-A1 CARBOCYCLIC PROLINAMIDE DERIVATIVES HTRA1, ADCYAP1R1, HTRA2 EPHX1 2203/4885CTSS 402/4885CTSK 983/4885
US-11866422-B2 Carbocyclic prolinamide derivatives HTRA1, ADCYAP1R1, HTRA2 EPHX1 2203/4885CTSS 402/4885CTSK 983/4885
US-11091465-B2 HTRA1, ALDH1A2, ADCYAP1R1 EPHX1 1905/4885CTSS 341/4885CTSK 823/4885
US-20210347762-A1 CARBOCYCLIC PROLINAMIDE DERIVATIVES HTRA1, ADCYAP1R1, HTRA2 EPHX1 2203/4885CTSS 402/4885CTSK 983/4885

“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.