Sugi Predict

Sugi Predict / Compounds / SCHEMBL7090174

SCHEMBL7090174

SCHEMBL7090174

N#Cc1ccc(Cn2cncc2CN(Cc2ccccc2)c2ccc(N3CCN(C(=O)c4ccc(Cl)s4)CC3)cc2)cc1.N#Cc1ccc(Cn2cncc2CNc2ccc(N3CCN(C(=O)c4ccc(Cl)s4)CC3)cc2)cc1

nearest known ligand 0.81

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ FNTA P49354 4/20 0.45
▸ FNTB P49356 4/20 0.45
▸ PGGT1B P53609 2/20 0.44

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
SCHEMBL6710981 0.94 FNTA (0.49) FNTAFNTBPGGT1B
SCHEMBL6708779 0.90 FNTA (0.51) FNTAFNTBPGGT1B
SCHEMBL6711125 0.88 FNTA (0.47) FNTAFNTB
SCHEMBL6708782 0.88 FNTA (0.49) FNTAFNTBPGGT1B
SCHEMBL6709670 0.87 FNTA (0.50) FNTAFNTBPGGT1B
SCHEMBL6712750 0.86 FNTA (0.49) FNTAFNTBPGGT1B
SCHEMBL6708845 0.86 FNTA (0.48) FNTAFNTBPGGT1B
SCHEMBL6708752 0.85 FNTA (0.46) FNTAFNTBPGGT1B
SCHEMBL6710804 0.85 FNTA (0.47) FNTAFNTBPGGT1B
SCHEMBL6711144 0.85 FNTA (0.46) FNTAFNTBPGGT1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1324999-A1 NOVEL AMINOPHENYL PIPERAZINE OR AMINOPHENYL PIPERIDINE DERIVATIVES INHIBITING PRENYL TRANSFERASE PROTEINS AND METHODS FOR PREPARING SAME PIERRE FABRE MEDICAMENT (FR) 2003-07-09 — — EP claimed
WO-2002030927-A1 NOVEL AMINOPHENYL PIPERAZINE OR AMINOPHENYL PIPERIDINE DERIVATIVES INHIBITING PRENYL TRANSFERASE PROTEINS AND METHODS FOR PREPARING SAME PIERRE FABRE MEDICAMENT (FR) 2002-04-18 — — WO claimed