SCHEMBL22285669

SCHEMBL22285669

CCC(=O)N[C@H](Cc1ccc(C#N)cc1)C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 3/20 0.52
ITGA2B P08514 3/20 0.52
GPR34 Q9UPC5 1/20 0.50
ACE P12821 5/20 0.48
MME P08473 5/20 0.48
CPA1 P15085 3/20 0.48
ACE2 Q9BYF1 3/20 0.48
ACACB O00763 1/20 0.46
CTSL P07711 1/20 0.45
CTSB P07858 1/20 0.45
CTSS P25774 1/20 0.45
NLRP3 Q96P20 1/20 0.45
PIN1 Q13526 1/20 0.44
ITGB1 P05556 1/20 0.44
ITGA4 P13612 1/20 0.44
FOLH1 Q04609 1/20 0.44

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
SCHEMBL22285670 1.00 ITGB3 (0.52) ITGB3ITGA2BGPR34ACEMME
SCHEMBL22302993 0.86 NLRP3 (0.59) ACACBNLRP3
SCHEMBL22338787 0.86 NLRP3 (0.59) ACACBNLRP3
SCHEMBL7292657 0.85 CTSS (0.56) ITGB3ITGA2BGPR34ACEMME
SCHEMBL5435245 0.85 CTSS (0.56) ITGB3ITGA2BGPR34ACEMME
SCHEMBL5435243 0.85 CTSS (0.56) ITGB3ITGA2BGPR34ACEMME
SCHEMBL9258153 0.82 MME (0.47) ITGB3ITGA2BGPR34ACEMME
SCHEMBL22338716 0.82 ACE (0.50) ITGB3ITGA2BACEMMECPA1
SCHEMBL4179483 0.82 FOLH1 (0.62) ITGB3ITGA2BACEMMECPA1
SCHEMBL4187321 0.82 FOLH1 (0.62) ITGB3ITGA2BACEMMECPA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230053746-A1 IL-17 LIGANDS AND USES THEREOF DICE MOLECULES SV, INC. 2023-02-23 US disclosed
EP-3921038-A1 IL-17A MODULATORS AND USES THEREOF Dice Alpha, Inc. (US) 2021-12-15 EP disclosed
WO-2020163554-A1 IL-17A MODULATORS AND USES THEREOF DICE ALPHA, INC. (US) 2020-08-13 WO disclosed
US-20200247785-A1 IL-17 Ligands And Uses Thereof DICE MOLECULES SV, INC. 2020-08-06 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-20230053746-A1 IL-17 LIGANDS AND USES THEREOF IL17A, IL2, IL15 ITGB3 487/4885ITGA2B 411/4885GPR34 1681/4885
US-20200247785-A1 IL-17 Ligands And Uses Thereof IL17A, IL2, IL15 ITGB3 487/4885ITGA2B 411/4885GPR34 1681/4885

“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.