SCHEMBL10028271

SCHEMBL10028271

COc1c(-c2ncccc2C(=O)O)ccc2ccncc12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.47
TDP1 Q9NUW8 1/20 0.47
MAOA P21397 2/20 0.40
CYP3A4 P08684 3/20 0.38
ALDH1A1 P00352 2/20 0.38
NPSR1 Q6W5P4 2/20 0.38
HTT P42858 2/20 0.38
DGAT2 Q96PD7 2/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
DHODH Q02127 1/20 0.36
CYP17A1 P05093 2/20 0.36
CYP11B1 P15538 2/20 0.36
CYP11B2 P19099 2/20 0.36
MAPT P10636 1/20 0.36
ALOX15 P16050 1/20 0.36
TSHR P16473 1/20 0.36
BLM P54132 1/20 0.36
AGER Q15109 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36

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
SCHEMBL10027756 0.86 KDM4E (0.50) KDM4ETDP1ALDH1A1NPSR1HTT
SCHEMBL10000600 0.85 KDM4E (0.51) KDM4ETDP1CYP3A4ALDH1A1NPSR1
SCHEMBL10028265 0.77 KDM4E (0.54) KDM4ETDP1CYP3A4ALDH1A1NPSR1
SCHEMBL10028270 0.77 MAOA (0.41) MAOACYP3A4HTTCYP17A1CYP11B1
SCHEMBL27967307 0.73 KDM4E (0.65) KDM4ETDP1CYP3A4ALDH1A1NPSR1
SCHEMBL10000621 0.72 KDM4E (0.59) KDM4ETDP1CYP3A4ALDH1A1NPSR1
Hydrochloric Acid SCHEMBL27967302 0.72 KDM4E (0.62) KDM4ETDP1CYP3A4ALDH1A1NPSR1
SCHEMBL10000561 0.72 KDM4E (0.54) KDM4ETDP1CYP3A4ALDH1A1NPSR1
SCHEMBL10028259 0.71 DHODH (0.42) KDM4EALDH1A1NPSR1NPC1RAB9A
SCHEMBL10028269 0.70 MAOA (0.47) KDM4ETDP1MAOACYP3A4HTT

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 KDM4E 3600/4885TDP1 2966/4885MAOA 930/4885
US-20120012824-A1 METAL COMPLEX COMPOUND AND ORGANIC LIGHT EMITTING DIODE DEVICE INCLUDING THE SAME AP1M1, MT-CO1, AP2M1 KDM4E 3600/4885TDP1 2966/4885MAOA 930/4885

“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.