SCHEMBL11538004

SCHEMBL11538004

O=C(Nc1ccc(Oc2ccccc2)cc1)Nc1ccccc1-n1ccnc1

nearest known ligand 0.64

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.64
▸ KMT2A Q03164 2/20 0.64
▸ LMNA P02545 1/20 0.52
▸ MAPT P10636 1/20 0.52
▸ NPSR1 Q6W5P4 1/20 0.52
▸ CYP3A4 P08684 2/20 0.49
▸ P2RY1 P47900 1/20 0.48
▸ CA12 O43570 4/20 0.47
▸ CA1 P00915 4/20 0.47
▸ CA2 P00918 4/20 0.47
▸ CA9 Q16790 4/20 0.47
▸ PORCN Q9H237 3/20 0.47
▸ RAF1 P04049 2/20 0.47
▸ NAMPT P43490 1/20 0.46
▸ CYP2D6 P10635 1/20 0.46
▸ IDO1 P14902 1/20 0.46
▸ IDH2 P48735 1/20 0.46
▸ KDR P35968 1/20 0.45
▸ MAPK14 Q16539 1/20 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
SCHEMBL11541657 0.90 MEN1 (0.76) MEN1KMT2ALMNAMAPTNPSR1
SCHEMBL11540166 0.85 KMT2A (0.60) MEN1KMT2AMAPTCYP3A4CA12
SCHEMBL11538807 0.84 KMT2A (0.67) MEN1KMT2ALMNAMAPTCYP3A4
SCHEMBL11539010 0.84 KMT2A (0.67) MEN1KMT2AMAPTCYP3A4CYP2D6
SCHEMBL11535044 0.84 MEN1 (0.78) MEN1KMT2ALMNAMAPTNPSR1
SCHEMBL11537127 0.84 MEN1 (0.67) MEN1KMT2ACYP3A4PORCNIDO1
SCHEMBL11536044 0.83 KMT2A (0.58) MEN1KMT2ALMNAMAPTCYP3A4
SCHEMBL11536064 0.82 KMT2A (0.65) MEN1KMT2AMAPTCYP3A4IDO1
SCHEMBL11472293 0.82 MEN1 (0.71) MEN1KMT2AMAPTNPSR1CYP3A4
SCHEMBL11537785 0.82 MEN1 (0.71) MEN1KMT2ALMNAMAPTRAF1

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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