Sugi Predict

Sugi Predict / Compounds / SCHEMBL6980923

SCHEMBL6980923

SCHEMBL6980923

N#Cc1ccc(Cn2cncc2CN(C(=O)CC(Oc2ccccc2)C(=O)N(Cc2cncn2Cc2ccc(C#N)cc2)c2ccc(N3CCN(C(=O)c4ccc(Cl)s4)CC3)cc2)c2ccc(N3CCN(C(=O)c4ccc(Cl)s4)CC3)cc2)cc1

nearest known ligand 0.74

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ FNTA P49354 5/20 0.43
▸ FNTB P49356 5/20 0.43
▸ PGGT1B P53609 3/20 0.41
▸ MAPT P10636 1/20 0.40

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
SCHEMBL6709676 0.89 FNTA (0.46) FNTAFNTBPGGT1BMAPT
SCHEMBL6709695 0.87 FNTA (0.48) FNTAFNTBPGGT1BMAPT
SCHEMBL6715084 0.86 FNTA (0.48) FNTAFNTBPGGT1BMAPT
SCHEMBL6708786 0.85 FNTA (0.48) FNTAFNTBPGGT1BMAPT
SCHEMBL6715117 0.84 FNTA (0.46) FNTAFNTBPGGT1B
SCHEMBL6710993 0.84 FNTA (0.49) FNTAFNTBPGGT1BMAPT
SCHEMBL6708741 0.83 FNTA (0.48) FNTAFNTBPGGT1BMAPT
SCHEMBL6714966 0.83 FNTA (0.48) FNTAFNTBPGGT1BMAPT
SCHEMBL6710981 0.82 FNTA (0.49) FNTAFNTBPGGT1BMAPT
SCHEMBL6708885 0.82 FNTA (0.46) FNTAFNTBPGGT1BMAPT

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