SCHEMBL1710167

SCHEMBL1710167

C(=Nc1ccccc1N=Cc1ccccc1)c1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.59
KDM4E B2RXH2 3/20 0.59
ALDH1A1 P00352 3/20 0.59
MAPT P10636 2/20 0.59
HPGD P15428 2/20 0.59
L3MBTL1 Q9Y468 2/20 0.57
CA2 P00918 4/20 0.50
CA12 O43570 3/20 0.50
CA9 Q16790 3/20 0.50
CA1 P00915 3/20 0.50
PTGS2 P35354 2/20 0.48
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
POLB P06746 1/20 0.47
HTT P42858 1/20 0.47
RAB9A P51151 1/20 0.47
BLM P54132 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
DHODH Q02127 1/20 0.46
NOX1 Q9Y5S8 1/20 0.44

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
SCHEMBL12633216 1.00 LMNA (0.59) LMNAKDM4EALDH1A1MAPTHPGD
SCHEMBL1870853 1.00 LMNA (0.59) LMNAKDM4EALDH1A1MAPTHPGD
SCHEMBL10714107 0.87 HPGD (0.53) LMNAKDM4EALDH1A1MAPTHPGD
SCHEMBL14524455 0.86 LMNA (0.55) LMNAKDM4EALDH1A1MAPTHPGD
SCHEMBL5078683 0.86 LMNA (0.55) LMNAKDM4EALDH1A1MAPTHPGD
SCHEMBL5078680 0.86 LMNA (0.55) LMNAKDM4EALDH1A1MAPTHPGD
SCHEMBL12633222 0.84 DHODH (0.51) LMNAKDM4EALDH1A1MAPTHPGD
SCHEMBL3727579 0.84 MAPT (0.50) LMNAKDM4EALDH1A1MAPTHPGD
SCHEMBL7636431 0.84 CYP2C9 (0.52) LMNAKDM4EALDH1A1MAPTHPGD
SCHEMBL1867533 0.84 DHODH (0.51) LMNAKDM4EALDH1A1MAPTHPGD

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-9217006-B2 Materials for organic electroluminescent devices MERCK PATENT GMBH (DE) 2015-12-22 US disclosed
EP-2344511-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES Merck Patent GmbH (DE) 2011-07-20 EP disclosed
US-20110108822-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2011-05-12 US disclosed
WO-2010054728-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2010-05-20 WO 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 (1 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-20110108822-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES ICMT, ORAI2, EPCAM LMNA 2068/4885KDM4E 3623/4885ALDH1A1 228/4885

“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.