SCHEMBL11537220

SCHEMBL11537220

O=C(Nc1cccc(Br)c1)Nc1ccccc1-n1ccnc1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.76
▸ KMT2A Q03164 1/20 0.76
▸ IDH2 P48735 3/20 0.52
▸ L3MBTL1 Q9Y468 1/20 0.48
▸ CYP3A4 P08684 1/20 0.48
▸ BTK Q06187 1/20 0.48
▸ PTGER3 P43115 1/20 0.47
▸ TRPV1 Q8NER1 1/20 0.47
▸ STING1 Q86WV6 1/20 0.47
▸ PDGFRB P09619 1/20 0.46
▸ KIT P10721 1/20 0.46
▸ FLT1 P17948 1/20 0.46
▸ FLT4 P35916 1/20 0.46
▸ KDR P35968 1/20 0.46
▸ IDO1 P14902 1/20 0.45
▸ GRIK1 P39086 3/20 0.45
▸ GRIK2 Q13002 2/20 0.45
▸ CDK8 P49336 1/20 0.44
▸ PARP1 P09874 1/20 0.44
▸ CD38 P28907 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
SCHEMBL11538807 0.88 KMT2A (0.67) MEN1KMT2AIDH2L3MBTL1CYP3A4
SCHEMBL11541657 0.86 MEN1 (0.76) MEN1KMT2AIDH2CYP3A4BTK
SCHEMBL11538930 0.86 MEN1 (0.76) MEN1KMT2AIDH2CYP3A4BTK
SCHEMBL11536552 0.86 KMT2A (1.00) MEN1KMT2AIDH2L3MBTL1CYP3A4
SCHEMBL11472293 0.83 MEN1 (0.71) MEN1KMT2AIDH2CYP3A4BTK
SCHEMBL11537785 0.83 MEN1 (0.71) MEN1KMT2APTGER3TRPV1
SCHEMBL11535043 0.83 IDH2 (0.72) MEN1KMT2AIDH2TRPV1KDR
SCHEMBL11538530 0.83 MEN1 (0.71) MEN1KMT2AIDH2CYP3A4BTK
SCHEMBL11541067 0.83 MEN1 (0.63) MEN1KMT2AIDH2L3MBTL1CYP3A4
SCHEMBL11469185 0.82 L3MBTL1 (0.68) MEN1KMT2AL3MBTL1CYP3A4IDO1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4160097-A INTERMEDIATES FOR FUNGICIDAL AND ANTIINFLAMMATORY 4-SUBSTITUTED IMIDAZO(1,2-A)QUINOXALINES WESTWIND PHARMACEUTICALS, INC. (US) 1979-07-03 — — US claimed
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