SCHEMBL6118199

SCHEMBL6118199

O=C1C(=O)c2cc3cccc(Br)c3cc2-c2ccccc21

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPRC P08575 7/20 0.50
MEN1 O00255 5/20 0.45
KMT2A Q03164 5/20 0.45
HTT P42858 4/20 0.45
MAPK1 P28482 4/20 0.45
S100A4 P26447 3/20 0.45
CES1 P23141 3/20 0.45
APAF1 O14727 3/20 0.45
NPC1 O15118 3/20 0.45
LMNA P02545 3/20 0.45
RAB9A P51151 3/20 0.45
GALK1 P51570 3/20 0.45
BLM P54132 3/20 0.45
SMN1; SMN2 Q16637 3/20 0.45
NPSR1 Q6W5P4 3/20 0.45
POLB P06746 3/20 0.45
MAPT P10636 3/20 0.45
TDP2 O95551 2/20 0.45
PLA2G1B P04054 2/20 0.45
PLCG1 P19174 2/20 0.45

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
SCHEMBL1234836 1.00 PTPRC (0.50) PTPRCMEN1KMT2AHTTMAPK1
SCHEMBL24991289 0.87 MEN1 (0.48) PTPRCMEN1KMT2AMAPK1CES1
SCHEMBL2198881 0.79 PTPRC (0.65) PTPRCMEN1KMT2AHTTMAPK1
SCHEMBL2700387 0.79 DNMT1 (0.59) PTPRCMEN1KMT2AHTTMAPK1
SCHEMBL25233080 0.77 MEN1 (0.48) MEN1KMT2AMAPK1NPSR1RXFP1
SCHEMBL5145444 0.75 PTPRC (0.59) PTPRCMEN1KMT2AHTTMAPK1
SCHEMBL17852139 0.75 ALDH1A1 (0.45) PTPRCMEN1KMT2AHTTMAPK1
SCHEMBL29440306 0.75 MEN1 (0.60) PTPRCMEN1KMT2AHTTMAPK1
SCHEMBL347152 0.75 MEN1 (0.60) PTPRCMEN1KMT2AHTTMAPK1
SCHEMBL29634247 0.75 MEN1 (0.60) PTPRCMEN1KMT2AHTTMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9499459-B2 Materials for organic electroluminescent devices MERCK PATENT GMBH (DE) 2016-11-22 US disclosed
US-20120126180-A1 NOVEL MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2012-05-24 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 (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-20120126180-A1 NOVEL MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MYB, L1CAM, SLC25A21 PTPRC 4129/4885MEN1 2326/4885KMT2A 2288/4885

“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.