SCHEMBL2555522

SCHEMBL2555522

COC(=O)c1cc(-n2c3ccccc3c3ccccc32)c(C(=O)OC)cc1-n1c2ccccc2c2ccccc21

nearest known ligand 0.57

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.57
LMNA P02545 3/20 0.57
NR4A2 P43354 3/20 0.55
KMT2A Q03164 3/20 0.53
MEN1 O00255 2/20 0.53
BRD4 O60885 2/20 0.50
KDM4E B2RXH2 2/20 0.49
THRB P10828 1/20 0.49
GAA P10253 1/20 0.49
MYC P01106 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.48
TSHR P16473 1/20 0.47
MAPT P10636 2/20 0.46

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
SCHEMBL29453524 0.95 ALDH1A1 (0.56) ALDH1A1LMNANR4A2KMT2AMEN1
SCHEMBL12281356 0.91 ALDH1A1 (0.50) ALDH1A1LMNANR4A2KMT2AMEN1
SCHEMBL2553966 0.91 ALDH1A1 (0.50) ALDH1A1LMNANR4A2KMT2AMEN1
SCHEMBL11926706 0.87 MYC (0.66) ALDH1A1LMNANR4A2KMT2AMEN1
SCHEMBL18624220 0.86 MAPT (0.56) ALDH1A1LMNANR4A2KMT2AMEN1
SCHEMBL14656964 0.85 NR4A2 (0.51) ALDH1A1LMNANR4A2KMT2AMEN1
SCHEMBL13352635 0.85 NR4A2 (0.48) ALDH1A1LMNANR4A2KMT2AMEN1
SCHEMBL18639316 0.85 ALDH1A1 (0.53) ALDH1A1LMNANR4A2KMT2AMEN1
SCHEMBL12282047 0.85 NR4A2 (0.48) ALDH1A1LMNANR4A2KMT2AMEN1
SCHEMBL14666395 0.84 MYC (0.59) ALDH1A1LMNANR4A2KMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9422287-B2 Bridged triarylamines and -phosphines as materials for electronic devices MERCK PATENT GMBH (DE) 2016-08-23 US disclosed
US-9422287-B2 Bridged triarylamines and -phosphines as materials for electronic devices MERCK PATENT GMBH (DE) 2016-08-23 US disclosed
US-9422287-B2 Bridged triarylamines and -phosphines as materials for electronic devices MERCK PATENT GMBH (DE) 2016-08-23 US disclosed
US-20130026422-A1 BRIDGED TRIARYLAMINES AND -PHOSPHINES AS MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2013-01-31 US disclosed
US-20130026422-A1 BRIDGED TRIARYLAMINES AND -PHOSPHINES AS MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2013-01-31 US disclosed
US-20130026422-A1 BRIDGED TRIARYLAMINES AND -PHOSPHINES AS MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2013-01-31 US disclosed
WO-2011128017-A1 BRIDGED TRIARYLAMINES AND -PHOSPHINES AS MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2011-10-20 WO disclosed
WO-2011128017-A1 BRIDGED TRIARYLAMINES AND -PHOSPHINES AS MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2011-10-20 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-20130026422-A1 BRIDGED TRIARYLAMINES AND -PHOSPHINES AS MATERIALS FOR ELECTRONIC DEVICES TEC, PNMT, TES ALDH1A1 612/4885LMNA 4237/4885NR4A2 2514/4885

“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.