SCHEMBL25735206

SCHEMBL25735206

O=C(NCCCCCCC1CCN(C(=O)c2ccco2)C1)Nc1cc(F)nc(F)c1

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ PKM P14618 2/20 0.46
▸ CCR3 P51677 4/20 0.42
▸ POLB P06746 1/20 0.41
▸ RAB9A P51151 1/20 0.40
▸ PTPN2 P17706 1/20 0.40
▸ PTPN1 P18031 1/20 0.40
▸ KMT2A Q03164 2/20 0.39
▸ NAMPT P43490 1/20 0.39
▸ ALDH1A1 P00352 3/20 0.39
▸ NPC1 O15118 1/20 0.39
▸ MAPT P10636 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ TDP1 Q9NUW8 1/20 0.38
▸ HTR1A P08908 1/20 0.38
▸ DRD2 P14416 1/20 0.38
▸ HTR2A P28223 1/20 0.38
▸ DRD3 P35462 1/20 0.38

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
SCHEMBL25735179 1.00 PKM (0.46) PKMCCR3POLBRAB9APTPN2
SCHEMBL25735202 0.92 PKM (0.44) PKMCCR3POLBRAB9APTPN2
SCHEMBL25735157 0.92 PKM (0.44) PKMCCR3POLBRAB9APTPN2
SCHEMBL25642318 0.87 PKM (0.41) PKMPOLBRAB9APTPN2PTPN1
SCHEMBL25643981 0.87 PKM (0.41) PKMPOLBRAB9APTPN2PTPN1
SCHEMBL25735151 0.87 NAMPT (0.46) PKMCCR3POLBRAB9APTPN2
SCHEMBL25735218 0.87 NAMPT (0.46) PKMCCR3POLBRAB9APTPN2
SCHEMBL25735190 0.87 NAMPT (0.46) PKMCCR3POLBRAB9APTPN2
SCHEMBL25735205 0.86 NAMPT (0.51) CCR3NAMPTHTR2A
SCHEMBL25735161 0.86 NAMPT (0.51) CCR3NAMPTHTR2A

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 PKM 221/4885CCR3 3581/4885POLB 2115/4885

“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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