SCHEMBL4055841

SCHEMBL4055841

CN(C)c1ccccc1-c1ccc2ccncc2c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDO2 P48775 2/20 0.55
▸ PIK3CD O00329 1/20 0.50
▸ PIK3CB P42338 1/20 0.50
▸ PIK3CG P48736 1/20 0.50
▸ PRKCZ Q05513 1/20 0.47
▸ PRKCI P41743 1/20 0.45
▸ CCNC P24863 8/20 0.44
▸ CDK8 P49336 8/20 0.44
▸ MAPK14 Q16539 2/20 0.43
▸ CSNK1D P48730 1/20 0.43
▸ MAPK11 Q15759 1/20 0.43
▸ CYP17A1 P05093 1/20 0.41
▸ CYP19A1 P11511 1/20 0.41
▸ CYP11B1 P15538 1/20 0.41
▸ CYP11B2 P19099 1/20 0.41
▸ HASPIN Q8TF76 1/20 0.40
▸ SLC22A12 Q96S37 1/20 0.40
▸ ABL1 P00519 1/20 0.40
▸ LCK P06239 1/20 0.39
▸ CSF1R P07333 1/20 0.39

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
SCHEMBL29450621 0.76 PRKCZ (0.60) TDO2PIK3CDPIK3CBPIK3CGPRKCZ
SCHEMBL4060891 0.76 ESR2 (0.57) TDO2PIK3CDPIK3CBPIK3CGPRKCZ
SCHEMBL18556708 0.75 CYP11B1 (0.69) TDO2PIK3CDPIK3CBPIK3CGPRKCZ
SCHEMBL3787569 0.75 MAPK11 (0.47) PIK3CDPRKCZMAPK14CSNK1DMAPK11
SCHEMBL15730609 0.74 PIK3CD (0.51) TDO2PIK3CDPIK3CBPIK3CGPRKCZ
SCHEMBL30165671 0.74 CYP2A6 (0.50) CYP17A1CYP19A1CYP11B1CYP11B2
SCHEMBL3789748 0.74 CYP2A6 (0.50) CYP17A1CYP19A1CYP11B1CYP11B2
SCHEMBL5007325 0.73 PRKCZ (0.70) TDO2PIK3CDPIK3CBPIK3CGPRKCZ
SCHEMBL30568926 0.73 PIK3CD (0.53) TDO2PIK3CDPIK3CBPIK3CGPRKCZ
SCHEMBL15723922 0.73 PIK3CD (0.50) TDO2PIK3CDPIK3CBPIK3CGPRKCZ

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-2049555-A2 ORGANIC IRIDIUM COMPOSITIONS AND THEIR USE IN ELECTRONIC DEVICES GENERAL ELECTRIC COMPANY (US) 2009-04-22 — — EP disclosed
WO-2008014037-A2 ORGANIC IRIDIUM COMPOSITIONS AND THEIR USE IN ELECTRONIC DEVICES GENERAL ELECTRIC COMPANY (US) 2008-01-31 — — WO disclosed
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