SCHEMBL29635622

SCHEMBL29635622

[2H]C([2H])([2H])C([2H])([2H])OC(=O)[C@H](Cc1ccc(F)cc1)NC(=O)[C@H](Cc1ccc(N(CCCl)CCCl)cc1)NC(=O)OC(C)(C)C

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ CTSS P25774 7/20 0.51
▸ CTSK P43235 6/20 0.51
▸ LMNA P02545 1/20 0.44
▸ SCN9A Q15858 3/20 0.41
▸ CTSL P07711 1/20 0.40
▸ CTSB P07858 1/20 0.40
▸ KMT2A Q03164 1/20 0.39
▸ HDAC8 Q9BY41 1/20 0.39
▸ PTPN1 P18031 3/20 0.38
▸ PTPRA P18433 1/20 0.38
▸ REN P00797 1/20 0.38

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
SCHEMBL29635623 1.00 CTSS (0.51) CTSSCTSKLMNASCN9ACTSL
SCHEMBL29635621 1.00 CTSS (0.51) CTSSCTSKLMNASCN9ACTSL
SCHEMBL20208717 0.90 CTSS (0.53) CTSSCTSKLMNASCN9ACTSL
SCHEMBL18239928 0.90 CTSS (0.53) CTSSCTSKLMNASCN9ACTSL
SCHEMBL28576290 0.87 LMNA (0.59) CTSSCTSKLMNASCN9ACTSL
SCHEMBL24101175 0.87 CTSS (0.52) CTSSCTSKLMNASCN9ACTSL
Melphalan Flufenamide SCHEMBL29409225 0.85 LMNA (0.48) CTSSCTSKLMNAKMT2A
SCHEMBL20202782 0.82 CTSS (0.54) CTSSCTSKSCN9ACTSLCTSB
SCHEMBL31255296 0.81 CTSS (0.52) CTSSCTSKSCN9ACTSLCTSB
SCHEMBL30138539 0.79 HDAC3 (0.46) CTSSCTSKLMNASCN9AHDAC8

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-12558337-B2 Formulations comprising melflufen ONCOPEPTIDES INNOVATION AB (SE) 2026-02-24 — — US disclosed
US-20220184021-A1 NOVEL FORMULATIONS COMPRISING MELFLUFEN ONCOPEPTIDES AB (SE) 2022-06-16 — — 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 (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-12558337-B2 Formulations comprising melflufen PHF8, EZH2, PHF2 CTSS 3207/4885CTSK 2082/4885LMNA 2045/4885
US-20220184021-A1 NOVEL FORMULATIONS COMPRISING MELFLUFEN F12, FGF2, MC3R CTSS 3982/4885CTSK 3527/4885LMNA 3215/4885

“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.

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