SCHEMBL25735150

SCHEMBL25735150

O=C(NCCCCCC1CCN(C(=O)c2ccc[nH]2)C1)Nc1ccnc(F)c1

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ CCR3 P51677 9/20 0.41
▸ BTK Q06187 1/20 0.41
▸ NAMPT P43490 7/20 0.41
▸ PRMT3 O60678 1/20 0.36
▸ AKR1C3 P42330 1/20 0.36
▸ HTR2A P28223 3/20 0.36
▸ SLC6A2 P23975 2/20 0.36
▸ SLC6A4 P31645 2/20 0.36
▸ SLC6A3 Q01959 2/20 0.36

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
SCHEMBL25735200 1.00 CCR3 (0.41) CCR3BTKNAMPTPRMT3AKR1C3
SCHEMBL25735208 0.91 NAMPT (0.42) CCR3BTKNAMPTPRMT3AKR1C3
SCHEMBL25735177 0.91 NAMPT (0.42) CCR3BTKNAMPTPRMT3AKR1C3
SCHEMBL25735158 0.88 KEAP1 (0.44) CCR3BTKNAMPT
SCHEMBL25735189 0.88 KEAP1 (0.44) CCR3BTKNAMPT
SCHEMBL25735219 0.88 KEAP1 (0.44) CCR3BTKNAMPT
SCHEMBL25642298 0.88 NAMPT (0.37) CCR3BTKNAMPTAKR1C3HTR2A
SCHEMBL25735265 0.87 NAMPT (0.48) CCR3BTKNAMPTHTR2ASLC6A2
SCHEMBL25735155 0.87 NAMPT (0.48) CCR3BTKNAMPTHTR2ASLC6A2
SCHEMBL25735199 0.87 NAMPT (0.48) CCR3BTKNAMPTHTR2ASLC6A2

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 CCR3 3581/4885BTK 1812/4885NAMPT 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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