SCHEMBL20985808

SCHEMBL20985808

O=C(O)CN1CCc2cc(Br)ccc2C1=O

nearest known ligand 0.59

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 20/20 0.59
ITGA2B P08514 20/20 0.59

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
SCHEMBL23321177 0.89 ITGB3 (0.53) ITGB3ITGA2B
SCHEMBL27822202 0.86 PRMT5 (0.47) ITGB3ITGA2B
SCHEMBL15939257 0.85 ITGB3 (0.50) ITGB3ITGA2B
SCHEMBL7796015 0.84 ITGB3 (0.60) ITGB3ITGA2B
SCHEMBL7797432 0.83 ITGB3 (0.63) ITGB3ITGA2B
SCHEMBL4881755 0.83 ITGB3 (0.59) ITGB3ITGA2B
SCHEMBL14061622 0.82 AOC3 (0.60) ITGB3ITGA2B
SCHEMBL29505381 0.82 AOC3 (0.60) ITGB3ITGA2B
SCHEMBL30530638 0.81 AOC3 (0.48) ITGB3ITGA2B
SCHEMBL25362979 0.81 AOC3 (0.48) ITGB3ITGA2B

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
CN-107567443-B Biaryl derivatives as GPR120 agonists 株式会社LG化学 2023-04-28 CN disclosed
US-10669252-B2 Benzazepine derivative, preparation method, pharmaceutical composition and use thereof Shanghai De Novo Pharmatech Co., Ltd. (CN) 2020-06-02 US disclosed
US-20190152941-A1 BENZAZEPINE DERIVATIVE, PREPARATION METHOD, PHARMACEUTICAL COMPOSITION AND USE THEREOF Shanghai De Novo Pharmatech Co., Ltd. (CN) 2019-05-23 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-10669252-B2 Benzazepine derivative, preparation method, pharmaceutical composition and use thereof TLR8, TLR1, TLR5 ITGB3 3015/4885ITGA2B 3930/4885
US-20190152941-A1 BENZAZEPINE DERIVATIVE, PREPARATION METHOD, PHARMACEUTICAL COMPOSITION AND USE THEREOF TLR8, TLR1, TLR5 ITGB3 3015/4885ITGA2B 3930/4885

“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.