SCHEMBL20248574

SCHEMBL20248574

Brc1cccc(C2Nc3ccccc3N2c2ccccc2)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
POLB P06746 3/20 0.42
KDM4E B2RXH2 6/20 0.40
RAB9A P51151 2/20 0.40
ALDH1A1 P00352 6/20 0.39
HPGD P15428 4/20 0.39
MAPT P10636 3/20 0.39
LMNA P02545 3/20 0.39
HTT P42858 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
MAPK1 P28482 1/20 0.39
GAA P10253 2/20 0.37
HSD17B10 Q99714 4/20 0.37
TSHR P16473 2/20 0.37
EPAS1 Q99814 2/20 0.36
PKM P14618 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
NPC1 O15118 2/20 0.35
USP2 O75604 1/20 0.35

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
SCHEMBL9795646 0.85 KDM4E (0.51) MEN1KMT2APOLBKDM4ERAB9A
SCHEMBL29360687 0.85 KDM4E (0.51) MEN1KMT2APOLBKDM4ERAB9A
SCHEMBL457928 0.84 RAB9A (0.49) MEN1KMT2APOLBKDM4ERAB9A
SCHEMBL22444376 0.83 KDM4E (0.50) MEN1KMT2APOLBKDM4ERAB9A
SCHEMBL10023111 0.83 RAB9A (0.47) MEN1KMT2APOLBKDM4ERAB9A
SCHEMBL17643005 0.82 KDM4E (0.62) MEN1KMT2APOLBKDM4ERAB9A
SCHEMBL19720277 0.80 KDM4E (0.34) POLBKDM4ERAB9AALDH1A1HPGD
SCHEMBL17854703 0.78 KDM4E (0.36) MEN1KMT2APOLBKDM4ERAB9A
SCHEMBL25946621 0.78 KDM4E (0.36) MEN1KMT2APOLBKDM4ERAB9A
SCHEMBL19369693 0.77 ALDH1A1 (0.40) MEN1KMT2APOLBKDM4ERAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11208401-B2 Materials for organic electroluminescent devices MERCK PATENT GMBH (DE) 2021-12-28 US disclosed
US-20180162843-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2018-06-14 US disclosed
US-20180162843-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2018-06-14 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-11208401-B2 Materials for organic electroluminescent devices DDT, CELF2, BRD3 MEN1 3573/4885KMT2A 2313/4885POLB 3761/4885
US-20180162843-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES DDT, CELF2, BRD3 MEN1 3573/4885KMT2A 2313/4885POLB 3761/4885

“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.