SCHEMBL19970835

SCHEMBL19970835

O=C(OCc1ccccc1)N1CCN(Cc2ccc3nc(-c4ccccc4)[nH]c3c2)CC1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCHE P06276 2/20 0.53
ACHE P22303 2/20 0.53
HTR1A P08908 1/20 0.51
DRD2 P14416 1/20 0.51
HTR2A P28223 1/20 0.51
CHEK2 O96017 6/20 0.51
HDAC6 Q9UBN7 4/20 0.50
GRIN2B Q13224 1/20 0.49
HDAC3 O15379 2/20 0.48
HDAC1 Q13547 2/20 0.48
HDAC2 Q92769 2/20 0.48
HDAC8 Q9BY41 2/20 0.48
SLC2A1 P11166 1/20 0.47
TNKS O95271 1/20 0.47
PARP1 P09874 1/20 0.47
TNKS2 Q9H2K2 1/20 0.47
PARP2 Q9UGN5 1/20 0.47
AURKA O14965 2/20 0.47
CDK1 P06493 2/20 0.47
CCNB1 P14635 2/20 0.47

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
SCHEMBL19970834 0.92 GRIN2B (0.49) BCHEACHECHEK2HDAC6GRIN2B
SCHEMBL19970764 0.92 AURKA (0.47) BCHEACHEHTR1ADRD2HTR2A
SCHEMBL19970777 0.91 SLC2A1 (0.58) BCHEACHECHEK2HDAC6HDAC3
SCHEMBL19986753 0.90 SLC2A1 (0.54) BCHEACHECHEK2HDAC6SLC2A1
SCHEMBL19970771 0.88 CBFB (0.53) GRIN2BTNKSPARP1TNKS2PARP2
SCHEMBL19970784 0.85 MGLL (0.59) BCHEACHECHEK2HDAC6GRIN2B
SCHEMBL19970763 0.85 KIT (0.45) GRIN2BTNKSPARP1TNKS2PARP2
SCHEMBL19970776 0.84 SLC2A1 (0.52) BCHEACHECHEK2GRIN2BSLC2A1
SCHEMBL19970755 0.84 GRIN2B (0.47) GRIN2BTNKSPARP1TNKS2PARP2
SCHEMBL23828687 0.82 SLC2A1 (0.49) GRIN2BSLC2A1

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 6 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
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 BCHE 2347/4885ACHE 3553/4885HTR1A 4493/4885
US-11479571-B2 Benzimidazol derivatives for treating filovirus infection FIP1L1, ZC3HAV1, MAVS BCHE 2347/4885ACHE 3553/4885HTR1A 4493/4885

“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.