SCHEMBL10027993

SCHEMBL10027993

COc1cccc2c1-c1ncccc1C2(C)C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLAU P00749 1/20 0.41
PDK2 Q15119 2/20 0.39
SYK P43405 1/20 0.37
PDGFRB P09619 1/20 0.37
PDGFRA P16234 1/20 0.37
SMN1; SMN2 Q16637 3/20 0.36
MEN1 O00255 2/20 0.36
NPC1 O15118 2/20 0.36
RAB9A P51151 2/20 0.36
KMT2A Q03164 2/20 0.36
LMNA P02545 1/20 0.36
GRM5 P41594 1/20 0.36
ASIC3 Q9UHC3 1/20 0.36
PDE10A Q9Y233 1/20 0.35
STK10 O94804 1/20 0.35
SLK Q9H2G2 1/20 0.35
ALDH1A1 P00352 2/20 0.35
POLB P06746 1/20 0.35
KDM4E B2RXH2 1/20 0.34
HPGD P15428 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
SCHEMBL10028267 0.83 PLAU (0.35) PLAUPDK2SYKPDGFRBPDGFRA
SCHEMBL10000543 0.78 PDK2 (0.60) PLAUPDK2MEN1NPC1RAB9A
SCHEMBL16547424 0.77 PDK2 (0.41) PDK2SMN1; SMN2MEN1KMT2ALMNA
SCHEMBL10000545 0.77 PDK2 (0.44) PDK2KMT2ALMNAALDH1A1KDM4E
SCHEMBL1335900 0.76 PDK2 (0.43) PDK2MEN1NPC1RAB9AKMT2A
SCHEMBL21226331 0.76 PDGFRB (0.42) PDK2SYKPDGFRBPDGFRASMN1; SMN2
SCHEMBL10027760 0.75 CYP11B1 (0.46) PDK2PDGFRBPDGFRANPC1PDE10A
SCHEMBL29894839 0.72 CA1 (0.50) PLAUSYKPDGFRBPDGFRASMN1; SMN2
SCHEMBL5702570 0.72 CA1 (0.50) PLAUSYKPDGFRBPDGFRASMN1; SMN2
SCHEMBL23175282 0.71 ALDH1A1 (0.48) PLAUSYKPDGFRBPDGFRASMN1; SMN2

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 PLAU 4328/4885PDK2 3422/4885SYK 3977/4885
US-20120012824-A1 METAL COMPLEX COMPOUND AND ORGANIC LIGHT EMITTING DIODE DEVICE INCLUDING THE SAME AP1M1, MT-CO1, AP2M1 PLAU 4328/4885PDK2 3422/4885SYK 3977/4885

“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.