SCHEMBL20786915

SCHEMBL20786915

CN(C)C(=O)Cn1ccc2cc(Br)ccc2c1=O

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ PSMB1 P20618 3/20 0.48
▸ PSMB5 P28074 3/20 0.48
▸ POLB P06746 2/20 0.47
▸ KRAS P01116 3/20 0.43
▸ NCEH1 Q6PIU2 3/20 0.42
▸ KDM4E B2RXH2 4/20 0.41
▸ LMNA P02545 1/20 0.39
▸ NTSR1 P30989 1/20 0.38
▸ ITGB3 P05106 1/20 0.38
▸ ITGA2B P08514 1/20 0.38
▸ GRIN2B Q13224 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.37
▸ MAPT P10636 1/20 0.37

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
SCHEMBL20808986 0.85 LMNA (0.44) KDM4ELMNAITGB3ITGA2BGRIN2B
SCHEMBL20786908 0.83 ITGB3 (0.51) PSMB1PSMB5POLBKDM4ENTSR1
SCHEMBL20808938 0.82 PSMB1 (0.48) PSMB1PSMB5POLBKRASKDM4E
SCHEMBL24248536 0.82 NLRP3 (0.40) PSMB1PSMB5POLBKDM4ELMNA
SCHEMBL21025176 0.82 GRIN2B (0.40) KDM4EITGB3ITGA2BGRIN2BMAPT
SCHEMBL20786879 0.82 TNF (0.51) PSMB1PSMB5POLBKDM4ELMNA
SCHEMBL20786929 0.81 PSMB1 (0.57) PSMB1PSMB5POLBKRASKDM4E
SCHEMBL20786895 0.79 PSMB1 (0.61) PSMB1PSMB5POLBKDM4ENTSR1
SCHEMBL1500208 0.78 PSMB1 (0.43) PSMB1PSMB5POLBKDM4ELMNA
SCHEMBL20786925 0.78 HTR2C (0.44) PSMB1PSMB5

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
EP-3453707-B1 BENZAZEPINE DERIVATIVE, PREPARATION METHOD, PHARMACEUTICAL COMPOSITION AND USE THEREOF SHANGHAI DE NOVO PHARMATECH CO LTD (CN) 2022-02-16 — — EP 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
EP-3453707-A1 BENZAZEPINE DERIVATIVE, PREPARATION METHOD, PHARMACEUTICAL COMPOSITION AND USE THEREOF Shanghai de Novo Pharmatech Co., Ltd. (CN) 2019-03-13 — — EP 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 PSMB1 3284/4885PSMB5 2461/4885POLB 4281/4885
US-20190152941-A1 BENZAZEPINE DERIVATIVE, PREPARATION METHOD, PHARMACEUTICAL COMPOSITION AND USE THEREOF TLR8, TLR1, TLR5 PSMB1 3284/4885PSMB5 2461/4885POLB 4281/4885

“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.

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