SCHEMBL19982564

SCHEMBL19982564

CCOP(=O)(Cc1cccc(COc2ccccc2CC2CCN(Cc3ccc4nc(-c5ccc(C(F)(F)F)cc5)[nH]c4c3)CC2)c1)OCC

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 2/20 0.42
CHEK2 O96017 11/20 0.41
BCHE P06276 2/20 0.40
ACHE P22303 2/20 0.40
DRD4 P21917 2/20 0.39
SIGMAR1 Q99720 2/20 0.39
DRD3 P35462 1/20 0.39
TMEM97 Q5BJF2 1/20 0.39
AKT1 P31749 1/20 0.37
AKT2 P31751 1/20 0.37
GRIN1 Q05586 1/20 0.36
GRIN2B Q13224 1/20 0.36
NPBWR1 P48145 1/20 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
SCHEMBL19970810 0.95 CHEK2 (0.41) SLC2A1CHEK2BCHEACHEAKT1
SCHEMBL19982656 0.94 DRD4 (0.42) SLC2A1CHEK2BCHEACHEDRD4
SCHEMBL19986770 0.93 BCHE (0.45) CHEK2BCHEACHEGRIN1GRIN2B
SCHEMBL19970723 0.93 CHEK2 (0.43) CHEK2BCHEACHE
SCHEMBL19982561 0.92 SLC2A1 (0.46) SLC2A1CHEK2DRD4SIGMAR1DRD3
SCHEMBL19970804 0.90 CNR2 (0.40) SLC2A1CHEK2BCHEACHEDRD4
SCHEMBL19970801 0.90 CHEK2 (0.43) SLC2A1CHEK2BCHEACHEDRD4
SCHEMBL19970824 0.88 BCHE (0.45) CHEK2BCHEACHEGRIN1GRIN2B
SCHEMBL23843060 0.88 CHEK2 (0.43) CHEK2BCHEACHEGRIN1GRIN2B
SCHEMBL19982578 0.87 SLC2A1 (0.45) SLC2A1NPBWR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11479571-B2 Benzimidazol derivatives for treating filovirus infection CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2022-10-25 US disclosed
US-20210292350-A1 BENZIMIDAZOL DERIVATIVES FOR TREATING FILOVIRUS INFECTION UNIVERSITE D'ORLEANS (FR) 2021-09-23 US disclosed
US-20210292350-A1 BENZIMIDAZOL DERIVATIVES FOR TREATING FILOVIRUS INFECTION UNIVERSITE D'ORLEANS (FR) 2021-09-23 US disclosed
WO-2018050771-A1 BENZIMIDAZOL DERIVATIVES FOR TREATING FILOVIRUS INFECTION CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2018-03-22 WO disclosed
EP-3296297-A1 BENZIMIDAZOL DERIVATIVES FOR TREATING FILOVIRUS INFECTION CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2018-03-21 EP 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 (2 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-20210292350-A1 BENZIMIDAZOL DERIVATIVES FOR TREATING FILOVIRUS INFECTION FIP1L1, ZC3HAV1, MAVS SLC2A1 4852/4885CHEK2 1795/4885BCHE 2347/4885
US-11479571-B2 Benzimidazol derivatives for treating filovirus infection FIP1L1, ZC3HAV1, MAVS SLC2A1 4852/4885CHEK2 1795/4885BCHE 2347/4885

“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.