SCHEMBL7097828

SCHEMBL7097828

Fc1cc(NN2CCCCCC2)cnc1Cl

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.34
ALDH1A1 P00352 1/20 0.34
GAA P10253 1/20 0.34
MEN1 O00255 3/20 0.33
KMT2A Q03164 3/20 0.33
KDM4E B2RXH2 2/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
KDM1A O60341 1/20 0.32
METAP2 P50579 1/20 0.32
KCNQ3 O43525 1/20 0.32
KCNQ2 O43526 1/20 0.32
HPGD P15428 2/20 0.31
CNR1 P21554 1/20 0.30
LMNA P02545 1/20 0.30
SHMT2 P34897 1/20 0.30

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
SCHEMBL7097813 1.00 MAPT (0.34) MAPTALDH1A1GAAMEN1KMT2A
SCHEMBL7101903 0.98 METAP2 (0.32) MAPTALDH1A1GAAMEN1KMT2A
SCHEMBL7097832 0.85 ALDH1A1 (0.38) MAPTALDH1A1GAAMEN1KMT2A
SCHEMBL7099158 0.85 ALDH1A1 (0.38) MAPTALDH1A1GAAMEN1KMT2A
SCHEMBL7103269 0.83 ALDH1A1 (0.36) MAPTALDH1A1GAAMEN1KMT2A
SCHEMBL7478327 0.82 ALDH1A1 (0.49) MAPTALDH1A1GAAMEN1KMT2A
SCHEMBL7099223 0.82 ALDH1A1 (0.49) MAPTALDH1A1GAAMEN1KMT2A
SCHEMBL7099156 0.82 FPR3 (0.37) MEN1KMT2AKDM4ESMN1; SMN2KDM1A
SCHEMBL7098002 0.82 CHRNB2 (0.37) MAPTALDH1A1GAA
SCHEMBL7100981 0.82 CHRNB2 (0.37) MAPTALDH1A1GAA

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
JP-2003500402-A 2003-01-07 JP claimed
CN-1361774-A Heterocyclic substituted amino nitrogen heterocycles as central nervous system medicaments ABBOTT INC (US) 2002-07-31 CN claimed
EP-1178982-A1 HETEROCYCLIC SUBSTITUTED AMINOAZACYCLES USEFUL AS CENTRAL NERVOUS SYSTEM AGENTS ABBOTT LABORATORIES (US) 2002-02-13 EP claimed
WO-2000071534-A1 HETEROCYCLIC SUBSTITUTED AMINOAZACYCLES USEFUL AS CENTRAL NERVOUS SYSTEM AGENTS ABBOTT LABORATORIES (US) 2000-11-30 WO claimed
EP-1178982-A1 HETEROCYCLIC SUBSTITUTED AMINOAZACYCLES USEFUL AS CENTRAL NERVOUS SYSTEM AGENTS ABBOTT LABORATORIES (US) 2002-02-13 EP disclosed
WO-2000071534-A1 HETEROCYCLIC SUBSTITUTED AMINOAZACYCLES USEFUL AS CENTRAL NERVOUS SYSTEM AGENTS ABBOTT LABORATORIES (US) 2000-11-30 WO disclosed