SCHEMBL10028264

SCHEMBL10028264

COc1c2c(cc3ccncc13)Cc1cccnc1-2

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 2/20 0.48
SCN9A Q15858 3/20 0.34
MAPT P10636 3/20 0.33
CYP3A4 P08684 2/20 0.33
KDR P35968 1/20 0.33
CYP17A1 P05093 1/20 0.33
CYP11B1 P15538 1/20 0.33
CYP11B2 P19099 1/20 0.33
CYP2A6 P11509 1/20 0.33
IDO1 P14902 2/20 0.32
TDO2 P48775 2/20 0.32
PDGFRB P09619 1/20 0.32
PDGFRA P16234 1/20 0.32
KDM4E B2RXH2 2/20 0.32
POLB P06746 1/20 0.32
HTT P42858 1/20 0.32
RAD52 P43351 1/20 0.32
PDE10A Q9Y233 1/20 0.32
CHEK1 O14757 1/20 0.32
ACHE P22303 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
SCHEMBL10027757 0.86 KDM4E (0.39) MAPTCYP3A4PDGFRBPDGFRAKDM4E
SCHEMBL10000598 0.84 CYP2A6 (0.39) MAOACYP2A6KDM4EPOLBHTT
SCHEMBL10028266 0.74 MAOA (0.47) MAOASCN9AMAPTIDO1TDO2
SCHEMBL10028269 0.74 MAOA (0.47) MAOASCN9AMAPTCYP3A4KDM4E
SCHEMBL10000560 0.70 CCR1 (0.37) MAPTCYP3A4CYP2A6KDM4EALDH1A1
SCHEMBL10028260 0.69 CTDSP1 (0.41) MAPTKDRCYP11B1CYP11B2IDO1
SCHEMBL10028268 0.69 CYP19A1 (0.36) MAPTCYP3A4CYP11B1CYP11B2CYP2A6
SCHEMBL10027988 0.69 ALDH1A1 (0.40) MAPTIDO1TDO2KDM4EPOLB
SCHEMBL10028271 0.68 KDM4E (0.47) MAOAMAPTCYP3A4CYP17A1CYP11B1
SCHEMBL30657488 0.68 TNF (0.36) MAPTCYP3A4CYP17A1CYP11B1CYP11B2

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 MAOA 930/4885SCN9A 1211/4885MAPT 2360/4885
US-20120012824-A1 METAL COMPLEX COMPOUND AND ORGANIC LIGHT EMITTING DIODE DEVICE INCLUDING THE SAME AP1M1, MT-CO1, AP2M1 MAOA 930/4885SCN9A 1211/4885MAPT 2360/4885

“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.