SCHEMBL30205697

SCHEMBL30205697

O=C(/C=C/c1ccc(F)c(-c2ccc3cc(S(=O)(=O)O)cc(SOOO)c3c2)c1)NCCCCC1CCN(C(=O)c2ccccc2)CC1

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ NAMPT P43490 15/20 0.48
▸ CYP3A4 P08684 1/20 0.48
▸ CYP2C9 P11712 1/20 0.48
▸ DRD2 P14416 1/20 0.35
▸ DRD3 P35462 1/20 0.35
▸ BCHE P06276 4/20 0.35
▸ ACHE P22303 4/20 0.35
▸ MAOA P21397 1/20 0.35
▸ MAOB P27338 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
SCHEMBL24948369 0.89 NAMPT (0.53) NAMPTCYP3A4CYP2C9BCHEACHE
SCHEMBL24947604 0.75 NAMPT (0.67) NAMPTCYP3A4CYP2C9BCHEACHE
SCHEMBL21060370 0.74 NAMPT (0.71) NAMPTCYP3A4CYP2C9BCHEACHE
SCHEMBL19317565 0.72 NAMPT (0.82) NAMPTCYP3A4CYP2C9BCHEACHE
SCHEMBL19834837 0.66 NAMPT (0.65) NAMPTCYP3A4CYP2C9BCHEACHE
Daporinad SCHEMBL82368 0.66 NAMPT (1.00) NAMPTCYP3A4CYP2C9
Daporinad SCHEMBL156944 0.66 NAMPT (1.00) NAMPTCYP3A4CYP2C9
SCHEMBL19834849 0.66 NAMPT (0.80) NAMPTCYP3A4CYP2C9BCHEACHE
Daporinad SCHEMBL82367 0.66 NAMPT (1.00) NAMPTCYP3A4CYP2C9
Daporinad SCHEMBL31181445 0.66 NAMPT (1.00) NAMPTCYP3A4CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4377300-A1 6-SUBSTITUTED NAPHTHALENE-1,3-DISULFONIC ACID DERIVATIVES AS MODULATORS OF THE EXTRACELLULAR NICOTINAMIDE PHOSPHORIBOSYL TRANSFERASE (ENAMPT) FOR THE TREATMENT OF E.G. DIABETES The University of Manchester (GB) 2024-06-05 — — EP claimed
WO-2023007147-A1 6-SUBSTITUTED NAPHTHALENE-1,3-DISULFONIC ACID DERIVATIVES AS MODULATORS OF THE EXTRACELLULAR NICOTINAMIDE PHOSPHORIBOSYL TRANSFERASE (ENAMPT) FOR THE TREATMENT OF E.G. DIABETES THE UNIVERSITY OF MANCHESTER (GB) 2023-02-02 — — WO claimed
EP-4377300-A1 6-SUBSTITUTED NAPHTHALENE-1,3-DISULFONIC ACID DERIVATIVES AS MODULATORS OF THE EXTRACELLULAR NICOTINAMIDE PHOSPHORIBOSYL TRANSFERASE (ENAMPT) FOR THE TREATMENT OF E.G. DIABETES The University of Manchester (GB) 2024-06-05 — — EP disclosed
WO-2023007147-A1 6-SUBSTITUTED NAPHTHALENE-1,3-DISULFONIC ACID DERIVATIVES AS MODULATORS OF THE EXTRACELLULAR NICOTINAMIDE PHOSPHORIBOSYL TRANSFERASE (ENAMPT) FOR THE TREATMENT OF E.G. DIABETES THE UNIVERSITY OF MANCHESTER (GB) 2023-02-02 — — WO disclosed
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