SCHEMBL29200426

SCHEMBL29200426

O=C(Nc1ccc(CCl)cc1)Nc1cccc(Cl)c1

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 10/20 0.72
KMT2A Q03164 10/20 0.72
MAPT P10636 6/20 0.72
LMNA P02545 6/20 0.72
HTT P42858 5/20 0.72
ALDH1A1 P00352 2/20 0.72
RAB9A P51151 7/20 0.71
NPC1 O15118 6/20 0.71
SMN1; SMN2 Q16637 3/20 0.64
L3MBTL1 Q9Y468 2/20 0.62
TP53 P04637 2/20 0.62
TSHR P16473 1/20 0.62
NFKB1 P19838 1/20 0.62
NFKB2 Q00653 1/20 0.62
RELA Q04206 1/20 0.62
NOX1 Q9Y5S8 1/20 0.62
CA12 O43570 1/20 0.61
CA1 P00915 1/20 0.61
CA2 P00918 1/20 0.61
CA9 Q16790 1/20 0.61

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
SCHEMBL29200402 0.89 MEN1 (0.74) MEN1KMT2AMAPTLMNAHTT
SCHEMBL30802713 0.89 MEN1 (0.74) MEN1KMT2AMAPTLMNAHTT
SCHEMBL17975955 0.88 MEN1 (0.72) MEN1KMT2AMAPTLMNAHTT
SCHEMBL29200429 0.88 MEN1 (0.72) MEN1KMT2AMAPTLMNAHTT
SCHEMBL4116578 0.86 MEN1 (0.70) MEN1KMT2AMAPTLMNAHTT
SCHEMBL11049956 0.85 MEN1 (0.85) MEN1KMT2AMAPTLMNAHTT
SCHEMBL2682054 0.85 KMT2A (1.00) MEN1KMT2AMAPTLMNAHTT
SCHEMBL17976408 0.84 MEN1 (0.66) MEN1KMT2AMAPTLMNAHTT
SCHEMBL4106743 0.84 MEN1 (0.66) MEN1KMT2AMAPTLMNAHTT
SCHEMBL10344695 0.83 MEN1 (1.00) MEN1KMT2AMAPTLMNAHTT

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
CN-117658868-A Benzamide derivative and preparation method and application thereof 中山大学 2024-03-08 CN disclosed