SCHEMBL21024933

SCHEMBL21024933

CCC(C(C)C)C1CN(C(=O)NC)C1

nearest known ligand 0.41

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.41
GAA P10253 1/20 0.30
CYP2C9 P11712 1/20 0.30
CYP2C19 P33261 1/20 0.30

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
SCHEMBL24449469 0.85 SMN1; SMN2 (0.41) GAACYP2C9CYP2C19
SCHEMBL19735097 0.77 POLB (0.50) POLB
SCHEMBL24449530 0.75 ALDH1A1 (0.39) POLBGAACYP2C9CYP2C19
SCHEMBL24449610 0.74 KMT2A (0.49) POLBGAACYP2C9CYP2C19
SCHEMBL24448858 0.73 LMNA (0.36) GAACYP2C9CYP2C19
SCHEMBL24449425 0.72 DPP4 (0.39) GAA
SCHEMBL13411430 0.71 POLB (0.48) POLBGAACYP2C9CYP2C19
SCHEMBL25961563 0.71 DPP4 (0.41) GAA
SCHEMBL24448934 0.71 EPHX2 (0.40) GAA
SCHEMBL24449565 0.71 LMNA (0.46) POLBGAACYP2C9CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 POLB 4281/4885GAA 3412/4885CYP2C9 373/4885
US-20190152941-A1 BENZAZEPINE DERIVATIVE, PREPARATION METHOD, PHARMACEUTICAL COMPOSITION AND USE THEREOF TLR8, TLR1, TLR5 POLB 4281/4885GAA 3412/4885CYP2C9 373/4885

“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.