SCHEMBL7469115

SCHEMBL7469115

O=C(C(=O)N1CCC[C@H]1CS(=O)(=O)C(CCc1ccccc1)CCc1ccccc1)c1cccnc1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
FKBP1A P62942 7/20 0.47
LMNA P02545 1/20 0.44
HRH3 Q9Y5N1 1/20 0.42
DPP4 P27487 2/20 0.41
ALDH1A1 P00352 2/20 0.41
KDM4E B2RXH2 1/20 0.41
ALOX15 P16050 1/20 0.41
MEN1 O00255 1/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
KMT2A Q03164 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
PREP P48147 1/20 0.39
FAP Q12884 1/20 0.39
DPP8 Q6V1X1 1/20 0.39
DPP9 Q86TI2 1/20 0.39
ACE P12821 1/20 0.39
EPHX2 P34913 1/20 0.39

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
SCHEMBL7462356 0.86 FKBP1A (0.51) FKBP1AHRH3DPP4ALDH1A1KDM4E
SCHEMBL7463760 0.82 FKBP1A (0.62) FKBP1A
SCHEMBL7470077 0.79 FKBP1A (0.58) FKBP1A
SCHEMBL7469127 0.78 FKBP1A (0.42) FKBP1ALMNAALDH1A1KDM4EALOX15
SCHEMBL7469822 0.76 FKBP1A (0.49) FKBP1AMEN1NPC1KMT2A
SCHEMBL7469124 0.74 FKBP1A (0.47) FKBP1AALDH1A1KDM4EALOX15EPHX2
SCHEMBL7561500 0.73 FKBP1A (0.49) FKBP1A
SCHEMBL7470890 0.69 FKBP1A (0.47) FKBP1A
SCHEMBL5966088 0.67 FKBP1A (0.60) FKBP1AACE
SCHEMBL7468444 0.66 FKBP1A (0.63) FKBP1A

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
EP-1204657-A1 PIPERIDINE AND PYRROLIDINE DERIVATIVES DISPLAYING NEURONAL ACTIVITY SCHERING AKTIENGESELLSCHAFT (DE) 2002-05-15 EP claimed
WO-2001012622-A1 PIPERIDINE AND PYRROLIDINE DERIVATIVES DISPLAYING NEURONAL ACTIVITY SCHERING AKTIENGESELLSCHAFT (DE) 2001-02-22 WO claimed
EP-1204657-A1 PIPERIDINE AND PYRROLIDINE DERIVATIVES DISPLAYING NEURONAL ACTIVITY SCHERING AKTIENGESELLSCHAFT (DE) 2002-05-15 EP disclosed
WO-2001012622-A1 PIPERIDINE AND PYRROLIDINE DERIVATIVES DISPLAYING NEURONAL ACTIVITY SCHERING AKTIENGESELLSCHAFT (DE) 2001-02-22 WO disclosed