SCHEMBL2845799

SCHEMBL2845799

O=C(O)c1cc2ccccc2c2cc(-c3c4ccccc4cc4ccccc34)ccc12

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.63
KMT2A Q03164 2/20 0.63
RXFP1 Q9HBX9 1/20 0.63
SOS1 Q07889 1/20 0.55
ALOX5 P09917 1/20 0.50
WDR5 P61964 1/20 0.49
KDM4E B2RXH2 2/20 0.47
CYP1A2 P05177 2/20 0.47
CYP2C19 P33261 2/20 0.47
HSD17B10 Q99714 2/20 0.47
ALDH1A1 P00352 1/20 0.47
GLA P06280 1/20 0.47
HPGD P15428 1/20 0.47
GPR35 Q9HC97 2/20 0.45
POLB P06746 2/20 0.45
DHODH Q02127 1/20 0.44
NR4A1 P22736 1/20 0.43
NR4A2 P43354 1/20 0.43
NR4A3 Q92570 1/20 0.43
CYP2D6 P10635 1/20 0.43

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
SCHEMBL2847759 0.90 MEN1 (0.58) MEN1KMT2ARXFP1SOS1WDR5
SCHEMBL522958 0.81 MEN1 (0.71) MEN1KMT2ARXFP1SOS1WDR5
SCHEMBL28588382 0.80 SOS1 (0.61) MEN1KMT2ARXFP1SOS1ALOX5
SCHEMBL15366577 0.79 ALOX5 (0.62) MEN1KMT2ASOS1ALOX5KDM4E
SCHEMBL2845802 0.78 ALOX5 (0.46) MEN1KMT2ARXFP1SOS1ALOX5
SCHEMBL2853503 0.78 MEN1 (1.00) MEN1KMT2ARXFP1SOS1WDR5
SCHEMBL10946505 0.76 MEN1 (0.65) MEN1KMT2ARXFP1SOS1WDR5
SCHEMBL21164720 0.75 KDM4E (0.55) MEN1KMT2AALOX5WDR5KDM4E
SCHEMBL29265485 0.74 WDR5 (0.71) MEN1KMT2ARXFP1SOS1WDR5
SCHEMBL10080476 0.74 MEN1 (0.61) MEN1KMT2ARXFP1SOS1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8993123-B2 Materials for organic electroluminescent devices MERCK PATENT GMBH (DE) 2015-03-31 US disclosed
US-8993123-B2 Materials for organic electroluminescent devices MERCK PATENT GMBH (DE) 2015-03-31 US disclosed
US-8993123-B2 Materials for organic electroluminescent devices MERCK PATENT GMBH (DE) 2015-03-31 US disclosed
US-20100327270-A1 NOVEL MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2010-12-30 US disclosed
US-20100327270-A1 NOVEL MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2010-12-30 US disclosed
US-20100327270-A1 NOVEL MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2010-12-30 US disclosed
EP-2240425-A1 NOVEL MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES Merck Patent GmbH (DE) 2010-10-20 EP disclosed
WO-2009100925-A1 NOVEL MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2009-08-20 WO disclosed
WO-2009100925-A1 NOVEL MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2009-08-20 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-20100327270-A1 NOVEL MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES L1CAM, ELAVL1, EPCAM MEN1 835/4885KMT2A 4115/4885RXFP1 3696/4885

“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.