SCHEMBL7327043

SCHEMBL7327043

O=C1CCCCCNCCCCCCN1

nearest known ligand 0.80

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 4/20 0.80
FKBP5 Q13451 1/20 0.80
OR51E2 Q9H255 1/20 0.67
KDM4E B2RXH2 2/20 0.48
GAA P10253 1/20 0.48
POLB P06746 1/20 0.48
ALDH1A1 P00352 3/20 0.45
TRIM24 O15164 1/20 0.35
TRIM33 Q9UPN9 1/20 0.35
MERTK Q12866 1/20 0.33
CXCR4 P61073 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
CTSD P07339 3/20 0.31

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
Piperidine SCHEMBL7976338 1.00 CRBN (0.80) CRBNFKBP5OR51E2KDM4EGAA
SCHEMBL7316123 1.00 CRBN (0.80) CRBNFKBP5OR51E2KDM4EGAA
SCHEMBL21238836 1.00 CRBN (0.80) CRBNFKBP5OR51E2KDM4EGAA
SCHEMBL21238842 1.00 CRBN (0.80) CRBNFKBP5OR51E2KDM4EGAA
SCHEMBL1833732 0.98 CRBN (0.76) CRBNFKBP5OR51E2KDM4EGAA
SCHEMBL21238727 0.97 CRBN (0.84) CRBNFKBP5OR51E2KDM4EGAA
SCHEMBL21238913 0.95 OR51E2 (0.75) CRBNFKBP5OR51E2KDM4EGAA
Piperidine SCHEMBL9851948 0.95 OR51E2 (0.75) CRBNFKBP5OR51E2KDM4EGAA
SCHEMBL21238909 0.95 OR51E2 (0.75) CRBNFKBP5OR51E2KDM4EGAA
SCHEMBL21238907 0.95 OR51E2 (0.75) CRBNFKBP5OR51E2KDM4EGAA

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-0527761-A1 PHOSPHONOPEPTIDES WITH COLLAGENASE INHIBITING ACTIVITY Beecham Group p.l.c. (GB) 1993-02-24 EP claimed
WO-1991015506-A1 PHOSPHONOPEPTIDES WITH COLLAGENASE INHIBITING ACTIVITY BEECHAM GROUP PLC (GB) 1991-10-17 WO claimed