SCHEMBL25735177

SCHEMBL25735177

O=C(NCCCCCC1CCN(C(=O)c2ccc[nH]2)C1)Nc1cc(F)nc(F)c1

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ NAMPT P43490 5/20 0.42
▸ BTK Q06187 1/20 0.41
▸ AKR1C3 P42330 1/20 0.39
▸ CCR3 P51677 9/20 0.38
▸ SLC6A2 P23975 3/20 0.36
▸ SLC6A4 P31645 3/20 0.36
▸ SLC6A3 Q01959 3/20 0.36
▸ PRMT3 O60678 1/20 0.36
▸ HTR2A P28223 2/20 0.35
▸ CYP2D6 P10635 1/20 0.35

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
SCHEMBL25735208 1.00 NAMPT (0.42) NAMPTBTKAKR1C3CCR3SLC6A2
SCHEMBL25735150 0.91 CCR3 (0.41) NAMPTBTKAKR1C3CCR3SLC6A2
SCHEMBL25735200 0.91 CCR3 (0.41) NAMPTBTKAKR1C3CCR3SLC6A2
SCHEMBL25643988 0.87 NAMPT (0.38) NAMPTBTKAKR1C3CCR3HTR2A
SCHEMBL25642319 0.87 NAMPT (0.38) NAMPTBTKAKR1C3CCR3HTR2A
SCHEMBL25735189 0.86 KEAP1 (0.44) NAMPTBTKCCR3
SCHEMBL25735158 0.86 KEAP1 (0.44) NAMPTBTKCCR3
SCHEMBL25735205 0.86 NAMPT (0.51) NAMPTBTKCCR3HTR2A
SCHEMBL25735219 0.86 KEAP1 (0.44) NAMPTBTKCCR3
SCHEMBL25735161 0.86 NAMPT (0.51) NAMPTBTKCCR3HTR2A

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 NAMPT 1/4885BTK 1812/4885AKR1C3 1712/4885

“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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