SCHEMBL10000558

SCHEMBL10000558

Cc1c2c(cc3ccccc13)C(=O)c1cccnc1-2

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.50
PTPRC P08575 2/20 0.46
CTSL P07711 1/20 0.46
CTSS P25774 1/20 0.46
PTPN13 Q12923 1/20 0.46
TDP2 O95551 1/20 0.46
NSD2 O96028 1/20 0.46
ABL1 P00519 1/20 0.46
PLCG1 P19174 1/20 0.46
CES1 P23141 1/20 0.46
PAX8 Q06710 1/20 0.46
RIN1 Q13671 1/20 0.46
TOP2A P11388 1/20 0.46
ATM Q13315 1/20 0.43
MAOA P21397 3/20 0.43
CCR1 P32246 2/20 0.43
CCR8 P51685 2/20 0.43
TDP1 Q9NUW8 2/20 0.42
MEN1 O00255 1/20 0.42
THRB P10828 1/20 0.42

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
SCHEMBL10000601 0.86 GAA (0.47) GAAPTPRCCTSLCTSSPTPN13
SCHEMBL10027755 0.82 GAA (0.46) GAAPTPRCCTSLCTSSPTPN13
SCHEMBL14445486 0.80 TTR (0.45) GAACES1ATMMEN1KMT2A
SCHEMBL10000578 0.79 CA12 (0.41) ABL1ATMMEN1KMT2A
SCHEMBL10000573 0.78 RAB9A (0.58) TDP2TOP2AATMTDP1MEN1
SCHEMBL10000566 0.77 KMT2A (0.38) GAACES1ATMMAOAMEN1
SCHEMBL17207363 0.74 CES1 (0.44) GAACES1ATMMAOAMEN1
SCHEMBL10000549 0.73 GAA (0.62) GAAPTPRCCTSLCTSSPTPN13
SCHEMBL6846875 0.73 TOP2A (0.54) GAAPTPRCCTSLCTSSPTPN13
SCHEMBL10028269 0.71 MAOA (0.47) GAATDP2NSD2ABL1PLCG1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150340628-A1 METAL COMPLEX COMPOUND AND ORGANIC LIGHT EMITTING DIODE DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO LTD (KR) 2015-11-26 US disclosed
US-9096529-B2 Metal complex compound and organic light emitting diode device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2015-08-04 US disclosed
US-20120012824-A1 METAL COMPLEX COMPOUND AND ORGANIC LIGHT EMITTING DIODE DEVICE INCLUDING THE SAME SAMSUNG MOBILE DISPLAY CO., LTD. (KR) 2012-01-19 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 (2 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-20150340628-A1 METAL COMPLEX COMPOUND AND ORGANIC LIGHT EMITTING DIODE DEVICE INCLUDING THE SAME AP1M1, MT-CO1, AP2M1 GAA 2857/4885PTPRC 4354/4885CTSL 3751/4885
US-20120012824-A1 METAL COMPLEX COMPOUND AND ORGANIC LIGHT EMITTING DIODE DEVICE INCLUDING THE SAME AP1M1, MT-CO1, AP2M1 GAA 2857/4885PTPRC 4354/4885CTSL 3751/4885

“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.