SCHEMBL9503736

SCHEMBL9503736

CC(C)[C@H](NC(=O)CCCc1ccccc1)C(=O)O

nearest known ligand 0.72

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.67
HPGD P15428 1/20 0.60
LMNA P02545 2/20 0.57
PKM P14618 1/20 0.57
HDAC1 Q13547 2/20 0.57
HDAC3 O15379 1/20 0.57
HDAC2 Q92769 1/20 0.57
HDAC8 Q9BY41 1/20 0.57
HDAC6 Q9UBN7 1/20 0.57
HDAC5 Q9UQL6 1/20 0.57
ALDH1A1 P00352 2/20 0.54
KMT2A Q03164 1/20 0.53
GAA P10253 1/20 0.52
FNTA P49354 1/20 0.52
FNTB P49356 1/20 0.52
CTSD P07339 1/20 0.52

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
SCHEMBL26616556 1.00 SMN1; SMN2 (0.67) SMN1; SMN2HPGDLMNAPKMHDAC1
SCHEMBL6446379 0.91 ALDH1A1 (0.56) SMN1; SMN2HDAC1HDAC3HDAC2HDAC8
SCHEMBL5711363 0.91 ALDH1A1 (0.56) SMN1; SMN2HDAC1HDAC3HDAC2HDAC8
SCHEMBL6136522 0.84 SMN1; SMN2 (0.70) SMN1; SMN2HPGDLMNAPKMHDAC1
SCHEMBL14997395 0.84 SMN1; SMN2 (0.70) SMN1; SMN2HPGDLMNAPKMHDAC1
SCHEMBL6136527 0.84 SMN1; SMN2 (0.70) SMN1; SMN2HPGDLMNAPKMHDAC1
SCHEMBL8241511 0.84 SMN1; SMN2 (0.74) SMN1; SMN2HPGDLMNAPKMHDAC1
SCHEMBL26710742 0.82 CCR1 (0.60) SMN1; SMN2HPGDLMNAPKMHDAC1
SCHEMBL9501718 0.82 CCR1 (0.60) SMN1; SMN2HPGDLMNAPKMHDAC1
SCHEMBL4412844 0.81 POLB (0.59) HPGDALDH1A1KMT2A

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-20250288559-A1 PREP BINDING LIGANDS POLKU THERAPEUTICS OY (FI) 2025-09-18 US disclosed
EP-4514781-A1 PREP BINDING LIGANDS Polku Therapeutics OY (FI) 2025-03-05 EP disclosed
CN-119451944-A PREP binding ligands 珀尔库治疗有限公司 2025-02-14 CN disclosed
WO-2023209191-A1 PREP BINDING LIGANDS UNIVERSITY OF HELSINKI (FI) 2023-11-02 WO disclosed
WO-2023209191-A1 PREP BINDING LIGANDS UNIVERSITY OF HELSINKI (FI) 2023-11-02 WO disclosed
US-10202418-B2 Hydroxy-ethylene derivatives for the treatment of arthrosis MERCK PATENT GMBH (DE) 2019-02-12 US disclosed
US-20160145297-A1 HYDROXY-ETHYLENE DERIVATIVES FOR THE TREATMENT OF ARTHROSIS MERCK PATENT GMBH (DE) 2016-05-26 US disclosed
US-20160145297-A1 HYDROXY-ETHYLENE DERIVATIVES FOR THE TREATMENT OF ARTHROSIS MERCK PATENT GMBH (DE) 2016-05-26 US disclosed
WO-2014198372-A1 HYDROXY-ETHYLENE DERIVATIVES FOR THE TREATMENT OF ARTHROSIS MERCK PATENT GMBH (DE) 2014-12-18 WO disclosed
EP-0232849-B1 PYRROLIDINEAMIDE DERIVATIVE OF ACYLAMINO ACID, PHARMACEUTICAL COMPOSITION AND USE SUNTORY LIMITED (JP) 1993-05-05 EP disclosed
US-5198458-A Pyrrolidineamide derivatives of acylamino acid and pharmaceutical composition containing the same SUNTORY LIMITED (JP) 1993-03-30 US disclosed
US-4826870-A CURING AMNESIA SUNTORY LIMITED (JP) 1989-05-02 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 (3 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-10202418-B2 Hydroxy-ethylene derivatives for the treatment of arthrosis CTSD, CTSE, CTSB SMN1; SMN2 4293/4885HPGD 45/4885LMNA 2218/4885
US-20160145297-A1 HYDROXY-ETHYLENE DERIVATIVES FOR THE TREATMENT OF ARTHROSIS CTSD, CTSE, CTSB SMN1; SMN2 4293/4885HPGD 45/4885LMNA 2218/4885
US-20250288559-A1 PREP BINDING LIGANDS PREP, ERAP2, CTSA SMN1; SMN2 3319/4885HPGD 3255/4885LMNA 1543/4885

“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.