SCHEMBL6559029

SCHEMBL6559029

CC(C)(C)OC(=O)NCC(C)(C)c1cn[nH]c1NC(c1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 3/20 0.37
BCHE P06276 1/20 0.36
CKS1B P61024 2/20 0.35
SKP1 P63208 2/20 0.35
SKP2 Q13309 2/20 0.35
ACACB O00763 3/20 0.35
ACACA Q13085 3/20 0.35
IDO1 P14902 1/20 0.35
KDM4A O75164 1/20 0.34
SYK P43405 1/20 0.34
CYP1A2 P05177 1/20 0.34

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
SCHEMBL6557087 0.79 SIGMAR1 (0.42) SIGMAR1BCHECKS1BSKP1SKP2
SCHEMBL6557081 0.78 NPSR1 (0.43) SIGMAR1BCHECKS1BSKP1SKP2
SCHEMBL6385864 0.77 BCHE (0.40) SIGMAR1BCHECKS1BSKP1SKP2
SCHEMBL5497823 0.76 SIGMAR1 (0.43) SIGMAR1BCHECKS1BSKP1SKP2
SCHEMBL630419 0.75 IDO1 (0.47) SIGMAR1IDO1KDM4ASYK
SCHEMBL6559439 0.75 TSHR (0.40) SIGMAR1BCHE
SCHEMBL6387372 0.74 CKS1B (0.42) SIGMAR1BCHECKS1BSKP1SKP2
SCHEMBL6557082 0.72 PRMT5 (0.40) BCHECKS1BSKP1SKP2IDO1
SCHEMBL6557080 0.70 AGTR1 (0.39) SIGMAR1BCHEKDM4ASYKCYP1A2
SCHEMBL6559033 0.70 KDM4E (0.40) BCHEKDM4ASYKCYP1A2

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-1392704-A1 CEPHEM COMPOUNDS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-03-03 EP disclosed
WO-2002090364-A1 CEPHEM COMPOUNDS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-11-14 WO disclosed