SCHEMBL25023290

SCHEMBL25023290

CCCCCCCCCC(=O)N[C@@H](Cc1ncc(-c2ccc(C(=O)OC)cc2)o1)C(=O)NCCCCCC

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ FAAH O00519 1/20 0.46
▸ GRIA1 P42261 1/20 0.45
▸ HDAC1 Q13547 11/20 0.44
▸ HDAC6 Q9UBN7 10/20 0.44
▸ HDAC3 O15379 3/20 0.44
▸ HDAC4 P56524 2/20 0.44
▸ HDAC7 Q8WUI4 2/20 0.44
▸ HDAC2 Q92769 2/20 0.44
▸ HDAC10 Q969S8 2/20 0.44
▸ HDAC11 Q96DB2 2/20 0.44
▸ HDAC8 Q9BY41 2/20 0.44
▸ HDAC9 Q9UKV0 2/20 0.44
▸ HDAC5 Q9UQL6 2/20 0.44
▸ LPAR3 Q9UBY5 4/20 0.43
▸ PTPN1 P18031 1/20 0.43
▸ LPAR1 Q92633 2/20 0.43
▸ MGLL Q99685 1/20 0.41

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
SCHEMBL25023302 0.91 GRIA1 (0.47) FAAHGRIA1HDAC1HDAC6HDAC3
SCHEMBL28969085 0.91 GRIA1 (0.47) FAAHGRIA1HDAC1HDAC6HDAC3
SCHEMBL25022775 0.85 LPAR3 (0.46) FAAHGRIA1LPAR3PTPN1LPAR1
SCHEMBL25023523 0.84 MGLL (0.45) FAAHHDAC1HDAC6HDAC3HDAC4
SCHEMBL30306745 0.84 SIRT2 (0.49) FAAH
SCHEMBL24073112 0.81 GRIA1 (0.46) GRIA1HDAC1HDAC6LPAR3PTPN1
SCHEMBL25022238 0.78 GRIA1 (0.48) GRIA1LPAR3LPAR1MGLL
SCHEMBL28969059 0.77 SIRT2 (0.51) —
SCHEMBL28969062 0.77 SIRT2 (0.51) —
SCHEMBL30306849 0.76 GRIA1 (0.47) FAAHGRIA1LPAR3PTPN1LPAR1

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
US-20240156780-A1 TLR2 MODULATOR COMPOUNDS, PHARMACEUTICAL COMPOSITIONS AND USES THEREOF AXIAL THERAPEUTICS, INC. (US) 2024-05-16 — — US disclosed
US-11951094-B2 TLR2 modulator compounds, pharmaceutical compositions and uses thereof AXIAL THERAPEUTICS, INC. (US) 2024-04-09 — — US disclosed
EP-4171547-A1 TLR2 MODULATOR COMPOUNDS, PHARMACEUTICAL COMPOSITIONS AND USES THEREOF Axial Therapeutics, Inc. (US) 2023-05-03 — — EP disclosed
US-20230051773-A1 TLR2 MODULATOR COMPOUNDS, PHARMACEUTICAL COMPOSITIONS AND USES THEREOF AXIAL THERAPEUTICS, INC. (US) 2023-02-16 — — US disclosed
US-20230051773-A1 TLR2 MODULATOR COMPOUNDS, PHARMACEUTICAL COMPOSITIONS AND USES THEREOF AXIAL THERAPEUTICS, INC. (US) 2023-02-16 — — 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 (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-20230051773-A1 TLR2 MODULATOR COMPOUNDS, PHARMACEUTICAL COMPOSITIONS AND USES THEREOF TLR2, TLR3, TLR4 FAAH 2978/4885GRIA1 596/4885HDAC1 599/4885
US-20240156780-A1 TLR2 MODULATOR COMPOUNDS, PHARMACEUTICAL COMPOSITIONS AND USES THEREOF TLR2, TLR3, TLR4 FAAH 2978/4885GRIA1 596/4885HDAC1 599/4885
US-11951094-B2 TLR2 modulator compounds, pharmaceutical compositions and uses thereof TLR2, TLR3, TLR4 FAAH 2978/4885GRIA1 596/4885HDAC1 599/4885

“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.

Send feedback