SCHEMBL19656678

SCHEMBL19656678

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

nearest known ligand 0.66

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.61
HDAC1 Q13547 2/20 0.55
HDAC3 O15379 1/20 0.55
HDAC2 Q92769 1/20 0.55
HDAC8 Q9BY41 1/20 0.55
HDAC6 Q9UBN7 1/20 0.55
HDAC5 Q9UQL6 1/20 0.55
HPGD P15428 1/20 0.55
LMNA P02545 1/20 0.52
PKM P14618 1/20 0.52
MMP2 P08253 8/20 0.50
MMP3 P08254 4/20 0.50
MMP1 P03956 1/20 0.50
MMP9 P14780 1/20 0.50
MMP14 P50281 1/20 0.50
ALDH1A1 P00352 1/20 0.49
KMT2A Q03164 1/20 0.49

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
SCHEMBL7478303 0.91 HDAC2 (0.53) SMN1; SMN2HDAC1HDAC3HDAC2HDAC8
SCHEMBL19640509 0.89 SMN1; SMN2 (0.58) SMN1; SMN2HDAC1HDAC3HDAC2HDAC8
SCHEMBL19640510 0.89 SMN1; SMN2 (0.58) SMN1; SMN2HDAC1HDAC3HDAC2HDAC8
SCHEMBL31685984 0.87 SMN1; SMN2 (0.57) SMN1; SMN2HDAC1HDAC3HDAC2HDAC8
SCHEMBL16114842 0.81 MEN1 (0.56) HDAC8HDAC6HPGDALDH1A1KMT2A
SCHEMBL7894643 0.81 MEN1 (0.56) HDAC8HDAC6HPGDALDH1A1KMT2A
SCHEMBL9503736 0.81 SMN1; SMN2 (0.67) SMN1; SMN2HDAC1HDAC3HDAC2HDAC8
SCHEMBL26616556 0.81 SMN1; SMN2 (0.67) SMN1; SMN2HDAC1HDAC3HDAC2HDAC8
SCHEMBL6136527 0.80 SMN1; SMN2 (0.70) SMN1; SMN2HDAC1HDAC3HDAC2HDAC8
SCHEMBL14997395 0.80 SMN1; SMN2 (0.70) SMN1; SMN2HDAC1HDAC3HDAC2HDAC8

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 3 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
WO-2023209191-A1 PREP BINDING LIGANDS UNIVERSITY OF HELSINKI (FI) 2023-11-02 WO disclosed
US-20170342046-A1 Fatty Acid Cysteine-Based Conjugates and Their Use in Treating Medical Disorders CATABASIS PHARMACEUTICALS, INC. 2017-11-30 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-20170342046-A1 Fatty Acid Cysteine-Based Conjugates and Their Use in Treating Medical Disorders CPT2, FABP1, ACAA2 SMN1; SMN2 2317/4885HDAC1 1243/4885HDAC3 437/4885
US-20250288559-A1 PREP BINDING LIGANDS PREP, ERAP2, CTSA SMN1; SMN2 3319/4885HDAC1 287/4885HDAC3 279/4885

“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.