SCHEMBL25922293

SCHEMBL25922293

CCCCOc1ccc(C[C@H](NC(=O)CC2CCN(C(=O)CCc3ccc(F)cc3)CC2)C(=O)O)cc1

nearest known ligand 0.72

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
YAP1 P46937 15/20 0.72
ITGB3 P05106 5/20 0.53
ITGA2B P08514 5/20 0.53

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
SCHEMBL25922296 0.93 YAP1 (0.74) YAP1ITGB3ITGA2B
SCHEMBL21359046 0.93 YAP1 (0.74) YAP1ITGB3ITGA2B
SCHEMBL21366139 0.93 YAP1 (0.74) YAP1ITGB3ITGA2B
SCHEMBL25922288 0.92 YAP1 (0.70) YAP1ITGB3ITGA2B
SCHEMBL25922291 0.92 YAP1 (0.72) YAP1ITGB3ITGA2B
SCHEMBL25922281 0.89 YAP1 (0.72) YAP1ITGB3ITGA2B
SCHEMBL23296248 0.88 YAP1 (0.92) YAP1
SCHEMBL19974535 0.88 YAP1 (0.92) YAP1
SCHEMBL25922285 0.87 YAP1 (0.70) YAP1ITGB3ITGA2B
SCHEMBL25754091 0.87 YAP1 (0.84) YAP1ITGB3ITGA2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230234924-A1 YAP1 INHIBITORS THAT TARGET THE INTERACTION OF YAP1 WITH OCT4 H. LEE MOFFITT CANCER CENTER AND RESEARCH INSTITUTE, INC. 2023-07-27 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 (1 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-20230234924-A1 YAP1 INHIBITORS THAT TARGET THE INTERACTION OF YAP1 WITH OCT4 YAP1, YES1, MYC YAP1 1/4885ITGB3 4602/4885ITGA2B 4535/4885

“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.