SCHEMBL19970772

SCHEMBL19970772

FC(F)(F)c1ccc(CN2CCN(Cc3ccc4[nH]c(-c5ccccn5)nc4c3)CC2)cc1

nearest known ligand 0.57

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CBFB Q13951 12/20 0.57
METAP2 P50579 5/20 0.47
METAP1 P53582 4/20 0.47
NPC1 O15118 2/20 0.46
LMNA P02545 2/20 0.46
PKM P14618 2/20 0.46
RAB9A P51151 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
KDM4E B2RXH2 1/20 0.46
MAPT P10636 1/20 0.46
KMT2A Q03164 1/20 0.46
HPGD P15428 1/20 0.46
MTOR P42345 1/20 0.46
SLC2A1 P11166 2/20 0.46
RUNX1 Q01196 2/20 0.45
KCNH2 Q12809 1/20 0.44
ACHE P22303 1/20 0.43

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
SCHEMBL19970773 0.92 CBFB (0.67) CBFBMETAP2METAP1NPC1LMNA
SCHEMBL19970768 0.87 SIGMAR1 (0.55) CBFBSLC2A1
SCHEMBL19970813 0.87 CBFB (0.60) CBFBMETAP2METAP1NPC1LMNA
SCHEMBL32660769 0.87 FAAH (0.57) CBFBKCNH2
SCHEMBL19970861 0.87 FAAH (0.57) CBFBKCNH2
SCHEMBL32660754 0.87 CBFB (0.46) CBFBSLC2A1KCNH2
SCHEMBL19970827 0.85 SLC2A1 (0.55) KDM4ESLC2A1KCNH2ACHE
SCHEMBL19970757 0.84 CBFB (0.58) CBFBMETAP2METAP1NPC1LMNA
SCHEMBL32660727 0.82 FAAH (0.57) CBFBLMNAMAPTKMT2A
SCHEMBL19970769 0.82 CBFB (0.56) CBFBSLC2A1

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-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
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 CBFB 3631/4885METAP2 4104/4885METAP1 3923/4885
US-11479571-B2 Benzimidazol derivatives for treating filovirus infection FIP1L1, ZC3HAV1, MAVS CBFB 3631/4885METAP2 4104/4885METAP1 3923/4885

“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.