SCHEMBL5225937

SCHEMBL5225937

CC(C)(C)OC(=O)NC1CCN(C(c2ccc(-c3ccc4c(c3)OCCO4)cc2)c2cn[nH]c2-c2ccco2)CC1

nearest known ligand 0.49

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
KDM4D Q6B0I6 20/20 0.49
KDM6A O15550 1/20 0.48

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
SCHEMBL5225926 0.73 MCHR1 (0.41) KDM4DKDM6A
SCHEMBL5230462 0.68 HTR1A (0.47)
SCHEMBL5226495 0.67 NPSR1 (0.44)
SCHEMBL2908342 0.66 ITGB2 (0.38) KDM4DKDM6A
SCHEMBL5224311 0.66 LMNA (0.45)
SCHEMBL21397260 0.66 MAPT (0.47) KDM4D
SCHEMBL5907259 0.66 P4HB (0.40)
Hydrochloric Acid SCHEMBL1997591 0.65 LMNA (0.50)
SCHEMBL20779663 0.63 OGA (0.64) KDM4D
SCHEMBL2907701 0.62 ALDH1A1 (0.40)

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-1611122-B1 SUBSTITUTED PYRAZOLE COMPOUNDS MERCK PATENT GMBH (DE) 2007-06-13 EP disclosed