SCHEMBL29200413

SCHEMBL29200413

O=C(Cc1cccc(Cl)c1)Nc1cccc(CCl)c1

nearest known ligand 0.66

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.66
KMT2A Q03164 2/20 0.66
ALDH1A1 P00352 1/20 0.66
KCNQ2 O43526 4/20 0.63
MAPT P10636 2/20 0.62
NLRP3 Q96P20 1/20 0.56
KCNJ5 P48544 1/20 0.56
KCNJ3 P48549 1/20 0.56
P2RY14 Q15391 1/20 0.55
KDM4E B2RXH2 1/20 0.54
ANO1 Q5XXA6 1/20 0.54
SELP P16109 1/20 0.53
SELE P16581 1/20 0.53
ROCK2 O75116 1/20 0.53
MAPK8 P45983 1/20 0.52
ACKR3 P25106 1/20 0.52
EPHX2 P34913 2/20 0.51
RORC P51449 1/20 0.51

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
SCHEMBL30802681 1.00 MEN1 (0.66) MEN1KMT2AALDH1A1KCNQ2MAPT
SCHEMBL29200420 0.88 MEN1 (0.66) MEN1KMT2AALDH1A1KCNQ2MAPT
SCHEMBL29200352 0.88 NLRP3 (0.72) MEN1KMT2AALDH1A1MAPTNLRP3
SCHEMBL30802696 0.88 MEN1 (0.66) MEN1KMT2AALDH1A1KCNQ2MAPT
SCHEMBL30802669 0.88 NLRP3 (0.72) MEN1KMT2AALDH1A1MAPTNLRP3
SCHEMBL29200447 0.84 KMT2A (0.57) MEN1KMT2AALDH1A1MAPTNLRP3
SCHEMBL30802694 0.84 KMT2A (0.57) MEN1KMT2AALDH1A1MAPTNLRP3
SCHEMBL11531211 0.83 KMT2A (0.76) MEN1KMT2AALDH1A1MAPTNLRP3
SCHEMBL29200402 0.83 MEN1 (0.74) MEN1KMT2AALDH1A1MAPT
SCHEMBL30802713 0.83 MEN1 (0.74) MEN1KMT2AALDH1A1MAPT

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