SCHEMBL25642298

SCHEMBL25642298

N#C/N=C(/NCCCCCCC1CCN(C(=O)c2ccc[nH]2)C1)Nc1ccnc(F)c1

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ NAMPT P43490 10/20 0.37
▸ CCR3 P51677 2/20 0.34
▸ USP30 Q70CQ3 2/20 0.33
▸ AKR1C3 P42330 1/20 0.33
▸ CHRM4 P08173 1/20 0.32
▸ BTK Q06187 1/20 0.32
▸ JAK1 P23458 1/20 0.31
▸ HTR2A P28223 1/20 0.31
▸ PIP5K1C O60331 1/20 0.31
▸ PIK3CA P42336 1/20 0.31
▸ CYP3A4 P08684 1/20 0.31
▸ CYP2C9 P11712 1/20 0.31

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
SCHEMBL26999597 1.00 NAMPT (0.37) NAMPTCCR3USP30AKR1C3CHRM4
SCHEMBL25643957 1.00 NAMPT (0.37) NAMPTCCR3USP30AKR1C3CHRM4
SCHEMBL26999047 1.00 NAMPT (0.37) NAMPTCCR3USP30AKR1C3CHRM4
SCHEMBL25642319 0.92 NAMPT (0.38) NAMPTCCR3USP30AKR1C3BTK
SCHEMBL25643988 0.92 NAMPT (0.38) NAMPTCCR3USP30AKR1C3BTK
SCHEMBL25221361 0.89 NAMPT (0.40) NAMPTBTKCYP3A4CYP2C9
SCHEMBL25642224 0.89 NAMPT (0.40) NAMPTBTKCYP3A4CYP2C9
SCHEMBL25642281 0.89 NAMPT (0.40) NAMPTBTKCYP3A4CYP2C9
SCHEMBL25225074 0.89 NAMPT (0.40) NAMPTBTKCYP3A4CYP2C9
SCHEMBL25642295 0.89 NAMPT (0.45) NAMPTCCR3USP30CYP3A4CYP2C9

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240067607-A1 Pyridinylcyanoguanidine Derivative and Use Thereof WANG, ZHEMING (CN) 2024-02-29 — — US disclosed
US-11873284-B2 Pyridinylcyanoguanidine derivative and use thereof WANG, Zheming (CN) 2024-01-16 — — US disclosed
US-20230192615-A1 Pyridinylcyanoguanidine Derivative and Use Thereof Rushi Biotech (Hangzhou) Co., Ltd (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 (3 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-20240067607-A1 Pyridinylcyanoguanidine Derivative and Use Thereof NAMPT, NAPRT, NNMT NAMPT 1/4885CCR3 2665/4885USP30 4484/4885
US-11873284-B2 Pyridinylcyanoguanidine derivative and use thereof NAMPT, NAPRT, NNT NAMPT 1/4885CCR3 2759/4885USP30 4432/4885
US-20230192615-A1 Pyridinylcyanoguanidine Derivative and Use Thereof NAMPT, NAPRT, NNT NAMPT 1/4885CCR3 2759/4885USP30 4432/4885

“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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