SCHEMBL10000576

SCHEMBL10000576

Cc1c2c(cc3ccccc13)C(C)(C)c1cc(-c3ccccc3)cnc1-2

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PSMB5 P28074 1/20 0.36
TDP1 Q9NUW8 2/20 0.35
CTDSP1 Q9GZU7 1/20 0.35
KDM4E B2RXH2 3/20 0.34
ALDH1A1 P00352 2/20 0.33
RAB9A P51151 2/20 0.33
IDO1 P14902 1/20 0.33
TDO2 P48775 1/20 0.33
MEN1 O00255 1/20 0.33
POLB P06746 1/20 0.33
MAPT P10636 1/20 0.33
PKM P14618 1/20 0.33
KMT2A Q03164 1/20 0.33
DHODH Q02127 3/20 0.33
TAAR1 Q96RJ0 2/20 0.33
PDGFRB P09619 2/20 0.33
PDGFRA P16234 1/20 0.33
AKT1 P31749 1/20 0.32
AXL P30530 1/20 0.32
CDK8 P49336 1/20 0.32

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
SCHEMBL10000580 0.86 KDM4E (0.39) PSMB5TDP1CTDSP1KDM4EALDH1A1
SCHEMBL10028258 0.84 IDO1 (0.41) TDP1CTDSP1ALDH1A1RAB9AIDO1
SCHEMBL10000562 0.79 PDK2 (0.39) TDP1KDM4EALDH1A1RAB9AMEN1
SCHEMBL10000564 0.77 MEN1 (0.36) TDP1KDM4EALDH1A1MEN1MAPT
SCHEMBL10000571 0.77 KMT2A (0.41) TDP1KDM4EALDH1A1RAB9AMEN1
SCHEMBL22910049 0.74 MEN1 (0.44) PSMB5KDM4EALDH1A1RAB9AMEN1
SCHEMBL10000577 0.73 PDGFRB (0.39) PSMB5TDP1CTDSP1KDM4ERAB9A
SCHEMBL10000578 0.72 CA12 (0.41) PSMB5RAB9AMEN1KMT2APDGFRB
SCHEMBL10000588 0.70 CA12 (0.43) KDM4EALDH1A1MAPTFLT3
SCHEMBL80941 0.69 PDK2 (0.45) TDP1KDM4EALDH1A1RAB9AMEN1

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 PSMB5 2309/4885TDP1 2966/4885CTDSP1 3421/4885
US-20120012824-A1 METAL COMPLEX COMPOUND AND ORGANIC LIGHT EMITTING DIODE DEVICE INCLUDING THE SAME AP1M1, MT-CO1, AP2M1 PSMB5 2309/4885TDP1 2966/4885CTDSP1 3421/4885

“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.