SCHEMBL3650463

SCHEMBL3650463

c1cnc(C23CCCC(CC2)CC3)nc1

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.31
GAA P10253 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
SCHEMBL28070877 0.91 HDAC8 (0.33) KDM4EGAA
SCHEMBL2015810 0.67 TSHR (0.42) KDM4E
SCHEMBL28059192 0.65 F2RL1 (0.36) KDM4EGAA
SCHEMBL3717375 0.64
SCHEMBL28203471 0.64 ESR2 (0.47)
SCHEMBL16597568 0.62 GRIN1 (0.31)
SCHEMBL9292272 0.61 GRIN1 (0.37) KDM4EGAA
SCHEMBL30477407 0.60 SLC6A2 (0.36) KDM4EGAA
SCHEMBL30477415 0.60 SLC6A2 (0.36) KDM4EGAA
SCHEMBL10605714 0.60 CHRM2 (0.41) KDM4E

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-2209781-A1 NOVEL 1,4-DIAZA-BICYCLOÝ3.2.2¨NONYL PYRIMIDINE DERIVATIVES AND THEIR MEDICAL USE NeuroSearch AS (DK) 2010-07-28 EP claimed
WO-2009062989-A1 NOVEL 1,4-DIAZA-BICYCLO[3.2.2]NONYL PYRIMIDINE DERIVATIVES AND THEIR MEDICAL USE NEUROSEARCH A/S (DK) 2009-05-22 WO claimed