SCHEMBL10000592

SCHEMBL10000592

Cc1cccc2c1-c1ncc(-c3cccc4ccccc34)cc1C2=O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 8/20 0.49
CA9 Q16790 8/20 0.49
CA1 P00915 7/20 0.49
CA2 P00918 7/20 0.49
ATM Q13315 1/20 0.46
KMT2A Q03164 2/20 0.43
EDNRB P24530 1/20 0.39
EDNRA P25101 1/20 0.39
MAPT P10636 2/20 0.39
RAB9A P51151 2/20 0.39
KDM4E B2RXH2 1/20 0.39
MEN1 O00255 1/20 0.39
APAF1 O14727 1/20 0.39
NPC1 O15118 1/20 0.39
TDP2 O95551 1/20 0.39
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.39
PKM P14618 1/20 0.39
HPGD P15428 1/20 0.39
MAOB P27338 1/20 0.39

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
SCHEMBL10027997 0.84 MAPT (0.54) CA12CA9CA1CA2KMT2A
SCHEMBL10000553 0.77 ALDH1A1 (0.43) CA12CA9CA1CA2ATM
SCHEMBL10000593 0.76 CA12 (0.43) CA12CA9CA1CA2KMT2A
SCHEMBL10000588 0.75 CA12 (0.43) CA12CA9CA1CA2MAPT
SCHEMBL10000578 0.74 CA12 (0.41) CA12CA9CA1CA2ATM
SCHEMBL10000590 0.73 MCL1 (0.53) CA12CA9CA1CA2KMT2A
SCHEMBL10000589 0.72 MCL1 (0.48) CA12CA9CA1CA2KMT2A
SCHEMBL24081975 0.71 ALDH1A1 (0.56) CA12CA9CA1CA2ATM
SCHEMBL10000549 0.70 GAA (0.62) KMT2AMEN1TDP2
SCHEMBL16805038 0.69 ENPP3 (0.49) CA12CA9CA1CA2ATM

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 CA12 2551/4885CA9 1580/4885CA1 1958/4885
US-20120012824-A1 METAL COMPLEX COMPOUND AND ORGANIC LIGHT EMITTING DIODE DEVICE INCLUDING THE SAME AP1M1, MT-CO1, AP2M1 CA12 2551/4885CA9 1580/4885CA1 1958/4885

“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.