SCHEMBL25735171

SCHEMBL25735171

O=C(NCCCCCC1CCN(C(=O)c2occc2F)C1)Nc1ccncc1

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ KEAP1 Q14145 4/20 0.44
▸ NFE2L2 Q16236 4/20 0.44
▸ NAMPT P43490 10/20 0.40
▸ CHRNB2 P17787 2/20 0.40
▸ CHRNB4 P30926 2/20 0.40
▸ CHRNA3 P32297 2/20 0.40
▸ CHRNA4 P43681 2/20 0.40
▸ EPHX2 P34913 1/20 0.38
▸ CCR3 P51677 2/20 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
SCHEMBL25271466 0.88 CHRNB2 (0.36) KEAP1NFE2L2NAMPTCHRNB2CHRNB4
SCHEMBL25642262 0.88 CHRNB2 (0.36) KEAP1NFE2L2NAMPTCHRNB2CHRNB4
SCHEMBL25735190 0.84 NAMPT (0.46) KEAP1NFE2L2NAMPTCCR3
SCHEMBL25735218 0.84 NAMPT (0.46) KEAP1NFE2L2NAMPTCCR3
SCHEMBL25735151 0.84 NAMPT (0.46) KEAP1NFE2L2NAMPTCCR3
SCHEMBL25735170 0.82 KEAP1 (0.42) KEAP1NFE2L2NAMPTCCR3
SCHEMBL25735186 0.82 NAMPT (0.56) KEAP1NFE2L2NAMPTCCR3
SCHEMBL25735181 0.82 NAMPT (0.56) KEAP1NFE2L2NAMPTCCR3
SCHEMBL25735223 0.82 NAMPT (0.56) KEAP1NFE2L2NAMPTCCR3
SCHEMBL25735147 0.82 NAMPT (0.56) KEAP1NFE2L2NAMPTCCR3

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 KEAP1 2515/4885NFE2L2 3310/4885NAMPT 1/4885

“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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