SCHEMBL6984513

SCHEMBL6984513

C=C(C)c1cccc(C2OCCO2)n1

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 1/20 0.32
NSD2 O96028 1/20 0.31
CASP6 P55212 1/20 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
SCHEMBL6980242 0.83 ALDH1A1 (0.38) CNR2
SCHEMBL6974332 0.76 CNR2 (0.34) CNR2
SCHEMBL6977764 0.74 CNR2 (0.33) CNR2
SCHEMBL23106869 0.73 CNR2 (0.34) CNR2
SCHEMBL13793158 0.73 KDM4E (0.46)
SCHEMBL1854614 0.73 CCR1 (0.46) NSD2CASP6
SCHEMBL7029297 0.72 NSD2 (0.33) NSD2CASP6
SCHEMBL6982026 0.71 RECQL (0.44)
SCHEMBL7026337 0.71 NSD2 (0.32) NSD2CASP6
SCHEMBL6986202 0.70 CHRNA7 (0.33) NSD2CASP6

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-0946546-B1 PYRIDIN-2-YL-METHYLAMINE DERIVATIVES, METHOD OF PREPARING AND APPLICATION AS MEDICINE PF MEDICAMENT (FR) 2003-06-25 EP disclosed
US-6020345-A Pyridin-2-yl-methylamine derivatives, method of preparing and application as medicine PIERRE FABRE MEDICAMENT (FR) 2000-02-01 US disclosed