SCHEMBL20804366

SCHEMBL20804366

Fc1cccc(CNCc2cc(CNCc3cccc(F)c3)cc(CNCc3cccc(F)c3)c2)c1

nearest known ligand 0.55

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MPO P05164 2/20 0.54
SCN8A Q9UQD0 1/20 0.51
TAAR1 Q96RJ0 3/20 0.50
ATM Q13315 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
IDO1 P14902 2/20 0.48
AGXT P21549 2/20 0.48
NOS1 P29475 2/20 0.47
KDM1A O60341 2/20 0.46
MAOA P21397 1/20 0.46
MAOB P27338 1/20 0.46

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
SCHEMBL21165344 0.89 MPO (0.57) MPOSCN8ATAAR1ATML3MBTL1
SCHEMBL26358055 0.89 ACHE (0.53) MPOSCN8ATAAR1ATML3MBTL1
SCHEMBL3360187 0.84 MAOB (0.54) MPOSCN8ATAAR1ATML3MBTL1
SCHEMBL11957878 0.83 MPO (0.55) MPOSCN8ATAAR1ATML3MBTL1
SCHEMBL2720282 0.83 MPO (0.55) MPOSCN8ATAAR1ATML3MBTL1
SCHEMBL30753812 0.83 MPO (0.55) MPOSCN8ATAAR1ATML3MBTL1
SCHEMBL184150 0.83 LMNA (0.61)
SCHEMBL14612436 0.82 TAAR1 (0.54) MPOSCN8ATAAR1IDO1AGXT
SCHEMBL28353482 0.82 MPO (0.58) MPOSCN8ATAAR1ATML3MBTL1
SCHEMBL30573214 0.82 MPO (0.58) MPOSCN8ATAAR1ATML3MBTL1

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
US-20230302030-A1 COMPOUNDS, PHARMACEUTICAL COMPOSITIONS AND USE THEREOF AS INHIBITORS OF RAN GTPase CENTRE HOSPITALIER DE L'UNIVERSITE DE MONTREAL (CA) 2023-09-28 US disclosed
US-20230302030-A1 COMPOUNDS, PHARMACEUTICAL COMPOSITIONS AND USE THEREOF AS INHIBITORS OF RAN GTPase CENTRE HOSPITALIER DE L'UNIVERSITE DE MONTREAL (CA) 2023-09-28 US disclosed
US-20200246365-A1 COMPOUNDS, PHARMACEUTICAL COMPOSITIONS AND USE THEREOF AS INHIBITORS OF RAN GTPASE CENTRE HOSPITALIER DE L'UNIVERSITÉ DE MONTRÉAL (CA) 2020-08-06 US disclosed
WO-2019046931-A1 COMPOUNDS, PHARMACEUTICAL COMPOSITIONS AND USE THEREOF AS INHIBITORS OF RAN GTPASE THE ROYAL INSTITUTION FOR THE ADVANCEMENT OF LEARNING/MCGILL UNIVERSITY (CA) 2019-03-14 WO 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-20200246365-A1 COMPOUNDS, PHARMACEUTICAL COMPOSITIONS AND USE THEREOF AS INHIBITORS OF RAN GTPASE RAN, RANBP1, GDI2 MPO 3469/4885SCN8A 1676/4885TAAR1 4769/4885
US-20230302030-A1 COMPOUNDS, PHARMACEUTICAL COMPOSITIONS AND USE THEREOF AS INHIBITORS OF RAN GTPase RAN, RANBP1, GDI2 MPO 3469/4885SCN8A 1676/4885TAAR1 4769/4885

“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.