SCHEMBL25735184

SCHEMBL25735184

O=C(NCCCCC[C@@H]1CCN(C(=O)c2cccs2)C1)Nc1ccncc1

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ PABPC1 P11940 1/20 0.45
▸ EIF4H Q15056 1/20 0.45
▸ KEAP1 Q14145 4/20 0.44
▸ NFE2L2 Q16236 4/20 0.44
▸ KDM4E B2RXH2 2/20 0.43
▸ ALDH1A1 P00352 4/20 0.43
▸ ABL1 P00519 1/20 0.43
▸ RIN1 Q13671 1/20 0.43
▸ TDP1 Q9NUW8 1/20 0.43
▸ NPC1 O15118 1/20 0.43
▸ MAPT P10636 1/20 0.43
▸ RAB9A P51151 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ NAMPT P43490 4/20 0.42

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
SCHEMBL25735183 1.00 PABPC1 (0.45) PABPC1EIF4HKEAP1NFE2L2KDM4E
SCHEMBL25735148 1.00 PABPC1 (0.45) PABPC1EIF4HKEAP1NFE2L2KDM4E
SCHEMBL25735188 1.00 PABPC1 (0.45) PABPC1EIF4HKEAP1NFE2L2KDM4E
SCHEMBL19834828 0.93 PABPC1 (0.50) PABPC1EIF4HKEAP1NFE2L2KDM4E
SCHEMBL25735164 0.91 CDK2 (0.53) PABPC1EIF4HKEAP1NFE2L2KDM4E
SCHEMBL25735198 0.91 CDK2 (0.53) PABPC1EIF4HKEAP1NFE2L2KDM4E
SCHEMBL25735204 0.89 KDM4E (0.41) PABPC1EIF4HKDM4EALDH1A1ABL1
SCHEMBL25735159 0.89 KDM4E (0.41) PABPC1EIF4HKDM4EALDH1A1ABL1
SCHEMBL25735207 0.88 PABPC1 (0.41) PABPC1EIF4HKDM4EALDH1A1ABL1
SCHEMBL25735162 0.88 PABPC1 (0.41) PABPC1EIF4HKDM4EALDH1A1ABL1

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-20230192651-A1 Pyrrolidine Derivative and Use Thereof WANG, ZHEMING (CN) 2023-06-22 — — US disclosed
US-20230192651-A1 Pyrrolidine Derivative and Use Thereof WANG, ZHEMING (CN) 2023-06-22 — — 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-20230192651-A1 Pyrrolidine Derivative and Use Thereof NAMPT, NAPRT, NNMT PABPC1 1223/4885EIF4H 3724/4885KEAP1 2515/4885

“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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