SCHEMBL7309640

SCHEMBL7309640

COc1ccn2cc(C(=O)c3cccc(C)c3C(C)C)nc2n1

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ESRRA P11474 2/20 0.35
GPR139 Q6DWJ6 2/20 0.34
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
HPGD P15428 1/20 0.33
CTSA P10619 1/20 0.33
NNMT P40261 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
SCHEMBL10856471 0.76
SCHEMBL11782841 0.70 KMT2A (0.46) ESRRAKDM4EALDH1A1HPGD
SCHEMBL15767066 0.68 SUV39H2 (0.32) GPR139KDM4EALDH1A1
SCHEMBL10304878 0.63 BRPF1 (0.43) KDM4EALDH1A1HPGD
SCHEMBL8291097 0.63 ALDH1A1 (0.57) KDM4EALDH1A1HPGD
SCHEMBL16592837 0.61 IRAK4 (0.44) KDM4EALDH1A1HPGD
SCHEMBL28541918 0.61 MAPT (0.53) KDM4EALDH1A1HPGD
SCHEMBL10861325 0.60
SCHEMBL8880159 0.60 KDM4E (0.42) KDM4EALDH1A1HPGD
SCHEMBL12447021 0.59 ALDH1A1 (0.39) KDM4EALDH1A1HPGD

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-0104104-A1 Imidazo(1,2-a)pyrimidines and their salts, process and intermediates for their preparation, their use as medicaments and compositions containing them ROUSSEL-UCLAF (FR) 1984-03-28 EP claimed