SCHEMBL5514484

SCHEMBL5514484

Oc1cc(-c2nnn[nH]2)cc2c1N(C1CCNCC1)c1ccccc1S2

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 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
SCHEMBL5505341 0.89 CYP2D6 (0.34) KDM1A
SCHEMBL5226012 0.87
SCHEMBL5114413 0.85 HTR2C (0.33) KDM1A
SCHEMBL5507880 0.80 PIM1 (0.35)
SCHEMBL5221409 0.79 OPRM1 (0.37)
SCHEMBL5507974 0.79 MKNK1 (0.36) KDM1A
SCHEMBL5506174 0.78 KDM1A (0.35) KDM1A
SCHEMBL5507708 0.76 LMNA (0.40) KDM1A
SCHEMBL5125807 0.73 CYP2D6 (0.37) KDM1A
SCHEMBL12537100 0.71 KDM1A (0.47) KDM1A

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-1846400-A2 TRICYCLIC DELTA-OPIOID MODULATORS JANSSEN PHARMACEUTICA N.V. (BE) 2007-10-24 EP claimed
WO-2006074388-A2 TRICYCLIC δ-OPIOID MODULATORS JANSSEN PHARMACEUTICA N.V. (BE) 2006-07-13 WO claimed
EP-1846400-A2 TRICYCLIC DELTA-OPIOID MODULATORS JANSSEN PHARMACEUTICA N.V. (BE) 2007-10-24 EP disclosed
WO-2006074388-A2 TRICYCLIC δ-OPIOID MODULATORS JANSSEN PHARMACEUTICA N.V. (BE) 2006-07-13 WO disclosed