SCHEMBL7462283

SCHEMBL7462283

C[C@@H]1CCC[C@H](C)N1CCN1CCCCC1C(N)=O

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SCN1A P35498 1/20 0.38
SCN2A Q99250 1/20 0.38
SCN3A Q9NY46 1/20 0.38
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
LMNA P02545 2/20 0.36
KCNK3 O14649 1/20 0.36
POLB P06746 1/20 0.35
HRH3 Q9Y5N1 4/20 0.35
CHRM2 P08172 1/20 0.35

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
SCHEMBL7462298 1.00 SCN1A (0.38) SCN1ASCN2ASCN3AMEN1KMT2A
SCHEMBL7462371 0.91 SCN1A (0.41) SCN1ASCN2ASCN3APOLB
SCHEMBL7462375 0.91 SCN1A (0.41) SCN1ASCN2ASCN3APOLB
SCHEMBL7465346 0.88 LMNA (0.34) SCN1ASCN2ASCN3AMEN1KMT2A
SCHEMBL7465335 0.88 LMNA (0.34) SCN1ASCN2ASCN3AMEN1KMT2A
SCHEMBL7464282 0.88 LMNA (0.34) SCN1ASCN2ASCN3AMEN1KMT2A
SCHEMBL7464291 0.88 LMNA (0.34) SCN1ASCN2ASCN3AMEN1KMT2A
SCHEMBL7466710 0.87 POLB (0.36) SCN1ASCN2ASCN3AMEN1KMT2A
SCHEMBL2761998 0.80 PARP1 (0.34) MEN1KMT2A
SCHEMBL2762080 0.80 PARP1 (0.34) MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1098894-B1 FKBP INHIBITORS PFIZER LTD (GB) 2002-10-02 EP disclosed