SCHEMBL19970779

SCHEMBL19970779

O=C(Nc1ccc(C(F)(F)F)cc1)N1CCN(Cc2ccc3nc(C(c4ccccc4)c4ccccc4)[nH]c3c2)CC1

nearest known ligand 0.60

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FAAH O00519 15/20 0.60
PRKAB2 O43741 4/20 0.56
PRKAG1 P54619 4/20 0.56
PRKAA2 P54646 4/20 0.56
PRKAA1 Q13131 4/20 0.56
PRKAG3 Q9UGI9 4/20 0.56
PRKAG2 Q9UGJ0 4/20 0.56
PRKAB1 Q9Y478 4/20 0.56
HIF1A Q16665 1/20 0.48
EPAS1 Q99814 1/20 0.48

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
SCHEMBL19970778 0.93 FAAH (0.60) FAAHPRKAB2PRKAG1PRKAA2PRKAA1
SCHEMBL19970871 0.89 FAAH (0.58) FAAH
SCHEMBL19970734 0.87 KCNH2 (0.48) FAAHPRKAB2PRKAG1PRKAA2PRKAA1
SCHEMBL19970728 0.86 FAAH (0.63) FAAHPRKAB2PRKAG1PRKAA2PRKAA1
SCHEMBL19970881 0.84 SIGMAR1 (0.58) FAAHPRKAB2PRKAG1PRKAA2PRKAA1
SCHEMBL19970870 0.82 FAAH (0.58) FAAH
SCHEMBL19970862 0.81 FAAH (0.57) FAAHPRKAB2PRKAG1PRKAA2PRKAA1
SCHEMBL19970733 0.80 CASP1 (0.43) FAAHHIF1AEPAS1
SCHEMBL19970830 0.79 FAAH (0.56) FAAHPRKAB2PRKAG1PRKAA2PRKAA1
SCHEMBL19970727 0.79 FAAH (0.63) FAAHPRKAB2PRKAG1PRKAA2PRKAA1

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 FAAH 3154/4885PRKAB2 2753/4885PRKAG1 2572/4885
US-11479571-B2 Benzimidazol derivatives for treating filovirus infection FIP1L1, ZC3HAV1, MAVS FAAH 3154/4885PRKAB2 2753/4885PRKAG1 2572/4885

“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.