SCHEMBL783331

SCHEMBL783331

COC(=O)c1ccccc1Nc1ccc2c(c1)c1ccccc1n2C(=O)O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.57
▸ ALOX15 P16050 1/20 0.57
▸ LMNA P02545 3/20 0.47
▸ SIRT2 Q8IXJ6 1/20 0.44
▸ KDM4E B2RXH2 5/20 0.43
▸ POLB P06746 2/20 0.43
▸ ATM Q13315 1/20 0.43
▸ KMT2A Q03164 6/20 0.43
▸ MEN1 O00255 4/20 0.43
▸ SRC P12931 1/20 0.42
▸ NR4A2 P43354 2/20 0.42
▸ TDP1 Q9NUW8 2/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ BLM P54132 1/20 0.41
▸ ALDH1A1 P00352 3/20 0.41
▸ THRB P10828 1/20 0.41
▸ GAA P10253 1/20 0.41
▸ CTSV O60911 1/20 0.41
▸ CTSL P07711 1/20 0.41
▸ HPGD P15428 2/20 0.41

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
SCHEMBL2787546 0.88 MAPT (0.56) MAPTALOX15LMNASIRT2KDM4E
SCHEMBL802087 0.86 MAPT (0.49) MAPTALOX15LMNASIRT2KDM4E
SCHEMBL12333415 0.82 MAPT (0.55) MAPTALOX15SIRT2KDM4EPOLB
SCHEMBL17849734 0.79 MAPT (0.49) MAPTALOX15LMNASIRT2KDM4E
SCHEMBL12334186 0.78 MAPT (0.59) MAPTALOX15SIRT2KDM4EPOLB
SCHEMBL15855471 0.78 MAPT (0.50) MAPTALOX15LMNASIRT2KDM4E
SCHEMBL14870530 0.78 KDM4E (0.56) MAPTKDM4EPOLBKMT2AMEN1
SCHEMBL13224505 0.76 MAPT (0.89) MAPTALOX15LMNASIRT2KDM4E
SCHEMBL31914 0.74 MAPT (1.00) MAPTALOX15LMNASIRT2KDM4E
SCHEMBL783228 0.74 MAPT (0.57) MAPTALOX15LMNASIRT2KDM4E

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9537105-B2 Materials for organic electroluminescent devices MERCK PATENT GMBH (DE) 2017-01-03 — — US disclosed
US-20150318478-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2015-11-05 — — US disclosed
US-9126970-B2 Materials for organic electroluminescent devices MERCK PATENT GMBH (DE) 2015-09-08 — — US disclosed
US-20120068170-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2012-03-22 — — 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-20150318478-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES SLCO2B1, SLCO1B3, SLCO4C1 MAPT 1399/4885ALOX15 1502/4885LMNA 630/4885
US-20120068170-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES SLCO2B1, SLCO1B3, SLCO4C1 MAPT 1399/4885ALOX15 1502/4885LMNA 630/4885

“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.

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