SCHEMBL25642319

SCHEMBL25642319

N#C/N=C(/NCCCCCCC1CCN(C(=O)c2ccc[nH]2)C1)Nc1cc(F)nc(F)c1

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ NAMPT P43490 11/20 0.38
▸ AKR1C3 P42330 2/20 0.35
▸ JAK2 O60674 1/20 0.31
▸ TBK1 Q9UHD2 1/20 0.31
▸ JAK1 P23458 1/20 0.31
▸ BTK Q06187 1/20 0.31
▸ USP30 Q70CQ3 1/20 0.31
▸ HTR2A P28223 1/20 0.31
▸ CCR3 P51677 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
SCHEMBL25643988 1.00 NAMPT (0.38) NAMPTAKR1C3JAK2TBK1JAK1
SCHEMBL25643957 0.92 NAMPT (0.37) NAMPTAKR1C3JAK1BTKUSP30
SCHEMBL26999047 0.92 NAMPT (0.37) NAMPTAKR1C3JAK1BTKUSP30
SCHEMBL26999597 0.92 NAMPT (0.37) NAMPTAKR1C3JAK1BTKUSP30
SCHEMBL25642298 0.92 NAMPT (0.37) NAMPTAKR1C3JAK1BTKUSP30
SCHEMBL25643996 0.92 NAMPT (0.39) NAMPTAKR1C3JAK1BTKUSP30
SCHEMBL25642322 0.92 NAMPT (0.39) NAMPTAKR1C3JAK1BTKUSP30
SCHEMBL25225074 0.88 NAMPT (0.40) NAMPTBTKCYP3A4CYP2C9
SCHEMBL25221361 0.88 NAMPT (0.40) NAMPTBTKCYP3A4CYP2C9
SCHEMBL25642242 0.88 NAMPT (0.46) NAMPTJAK1CYP3A4CYP2C9

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 1/4885AKR1C3 1604/4885JAK2 1044/4885
US-11873284-B2 Pyridinylcyanoguanidine derivative and use thereof NAMPT, NAPRT, NNT NAMPT 1/4885AKR1C3 1653/4885JAK2 1011/4885
US-20230192615-A1 Pyridinylcyanoguanidine Derivative and Use Thereof NAMPT, NAPRT, NNT NAMPT 1/4885AKR1C3 1653/4885JAK2 1011/4885

“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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