SCHEMBL2880254

SCHEMBL2880254

O=C([O-])c1cccnc1-c1cc2ccccc2s1.O=C([O-])c1cccnc1-c1cc2ccccc2s1.O=C([O-])c1cccnc1-c1cc2ccccc2s1.[Ir+3]

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IKBKB O14920 4/20 0.42
CYP19A1 P11511 1/20 0.42
PLAU P00749 1/20 0.42
CDC7 O00311 1/20 0.41
STK17B O94768 2/20 0.40
STK17A Q9UEE5 2/20 0.40
CAMKK1 Q8N5S9 1/20 0.40
AURKB Q96GD4 1/20 0.40
CAMKK2 Q96RR4 1/20 0.40
PIM2 Q9P1W9 1/20 0.40
JAK2 O60674 1/20 0.40
JAK3 P52333 1/20 0.40
APP P05067 1/20 0.40
TBK1 Q9UHD2 1/20 0.40
CHUK O15111 1/20 0.40
IKBKG Q9Y6K9 1/20 0.40
CA1 P00915 2/20 0.39
CA2 P00918 2/20 0.39
CA9 Q16790 2/20 0.39
CA12 O43570 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
SCHEMBL2877899 0.86 KDM4E (0.56) IKBKBCYP19A1PLAUCDC7STK17B
SCHEMBL2880255 0.85 KDM4E (0.54) IKBKBCYP19A1PLAUCDC7STK17B
SCHEMBL31661936 0.85 IKBKB (0.52) IKBKBCYP19A1PLAUCDC7JAK2
SCHEMBL29986368 0.77 CYP19A1 (0.48) IKBKBCYP19A1PLAUAPPCKS1B
SCHEMBL15260648 0.75 CYP19A1 (0.49) IKBKBCYP19A1PLAUAPPCA1
SCHEMBL2875320 0.74 ERN1 (0.48) CYP19A1APPCA1CA2CA9
SCHEMBL29177680 0.74 CYP19A1 (0.48) IKBKBCYP19A1PLAUAPPCA1
SCHEMBL28401036 0.74 CYP19A1 (0.48) IKBKBCYP19A1PLAUCDC7APP
SCHEMBL28537163 0.73 IKBKB (0.40) IKBKBCYP19A1PLAUCDC7STK17B
SCHEMBL28579081 0.73 CYP19A1 (0.43) IKBKBCYP19A1CDC7STK17BSTK17A

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8420231-B2 Iridium phosphorescent dendrimer, method of preparing the same and electroluminescent device including the iridium phosphorescent dendrimer SAMSUNG ELECTRONICS CO., LTD. (KR) 2013-04-16 US claimed
US-20100084970-A1 IRIDIUM PHOSPHORESCENT DENDRIMER, METHOD OF PREPARING THE SAME AND ELECTROLUMINESCENT DEVICE INCLUDING THE IRIDIUM PHOSPHORESCENT DENDRIMER SAMSUNG ELECTRONICS CO., LTD (KR) 2010-04-08 US claimed
US-8420231-B2 Iridium phosphorescent dendrimer, method of preparing the same and electroluminescent device including the iridium phosphorescent dendrimer SAMSUNG ELECTRONICS CO., LTD. (KR) 2013-04-16 US disclosed
US-20100084970-A1 IRIDIUM PHOSPHORESCENT DENDRIMER, METHOD OF PREPARING THE SAME AND ELECTROLUMINESCENT DEVICE INCLUDING THE IRIDIUM PHOSPHORESCENT DENDRIMER SAMSUNG ELECTRONICS CO., LTD (KR) 2010-04-08 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100084970-A1 IRIDIUM PHOSPHORESCENT DENDRIMER, METHOD OF PREPARING THE SAME AND ELECTROLUMINESCENT DEVICE INCLUDING THE IRIDIUM PHOSPHORESCENT DENDRIMER DNM1, FIS1, DCUN1D1 IKBKB 4609/4885CYP19A1 3384/4885PLAU 1565/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.