SCHEMBL2495994

SCHEMBL2495994

COc1ccccc1C1(NCC(=O)N(C)C)C(=O)Nc2ccc(Cl)cc21

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.44
▸ CBX7 O95931 2/20 0.43
▸ CDYL Q9Y232 2/20 0.43
▸ IDO1 P14902 2/20 0.42
▸ ADCY8 P40145 1/20 0.40
▸ ADAMTS5 Q9UNA0 3/20 0.38
▸ ACHE P22303 2/20 0.38
▸ MMP13 P45452 2/20 0.38
▸ ADAM17 P78536 2/20 0.38
▸ KCNMA1 Q12791 2/20 0.38
▸ KCNQ3 O43525 1/20 0.38
▸ KCNQ2 O43526 1/20 0.38
▸ KCNQ4 P56696 1/20 0.38
▸ KCNQ5 Q9NR82 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ LMNA P02545 1/20 0.38
▸ GAA P10253 1/20 0.38
▸ MMP2 P08253 2/20 0.37
▸ MMP3 P08254 1/20 0.37

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
SCHEMBL5675323 0.89 CBX7 (0.47) KMT2ACBX7CDYLIDO1ADCY8
SCHEMBL2496818 0.86 KMT2A (0.42) KMT2ACBX7CDYLIDO1ADCY8
SCHEMBL2498534 0.84 CBX7 (0.39) KMT2ACBX7CDYLIDO1ADCY8
SCHEMBL5677735 0.83 KMT2A (0.44) KMT2ACBX7CDYLIDO1ADCY8
SCHEMBL2499409 0.82 CBX7 (0.38) KMT2ACBX7CDYLIDO1ADCY8
SCHEMBL2495320 0.82 KMT2A (0.42) KMT2ACBX7CDYLIDO1ADCY8
SCHEMBL2497477 0.82 KMT2A (0.42) KMT2ACBX7CDYLIDO1ADCY8
SCHEMBL2492996 0.82 KMT2A (0.42) KMT2ACBX7CDYLIDO1ADCY8
SCHEMBL2496408 0.81 CBX7 (0.40) KMT2ACBX7CDYLIDO1ADCY8
SCHEMBL2492829 0.81 KMT2A (0.40) KMT2ACBX7CDYLIDO1ADCY8

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-8030499-B2 1,3-dihydro-2H-indole-2-one compound and pyrrolidine-2-one compound fused with aromatic heterocycle TAISHO PHARMACEUTICAL CO., LTD. (JP) 2011-10-04 — — US disclosed
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