SCHEMBL5677735

SCHEMBL5677735

COc1ccccc1C1(NCCC(=O)O)C(=O)Nc2ccc(Cl)cc21

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.44
▸ CBX7 O95931 1/20 0.43
▸ CDYL Q9Y232 1/20 0.43
▸ IDO1 P14902 2/20 0.42
▸ ACHE P22303 4/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ LMNA P02545 1/20 0.40
▸ GAA P10253 1/20 0.40
▸ KCNMA1 Q12791 2/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ HIF1A Q16665 1/20 0.39
▸ ADAMTS5 Q9UNA0 2/20 0.38
▸ ADCY8 P40145 1/20 0.38
▸ MMP13 P45452 1/20 0.38
▸ ADAM17 P78536 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 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

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) KMT2ACBX7CDYLIDO1ACHE
SCHEMBL2494090 0.88 KMT2A (0.41) KMT2ACBX7CDYLIDO1ACHE
SCHEMBL7464164 0.86 IDO1 (0.43) KMT2ACBX7CDYLIDO1MEN1
SCHEMBL27509234 0.84 KMT2A (0.41) KMT2ACBX7CDYLIDO1ACHE
SCHEMBL2495994 0.83 KMT2A (0.44) KMT2ACBX7CDYLIDO1ACHE
SCHEMBL2496818 0.82 KMT2A (0.42) KMT2ACBX7CDYLIDO1ACHE
SCHEMBL2492359 0.78 CBX7 (0.48) KMT2ACBX7CDYLIDO1ACHE
SCHEMBL5674067 0.78 BRD4 (0.48) KMT2ACBX7CDYLIDO1ACHE
SCHEMBL27511771 0.78 BRD4 (0.48) KMT2ACBX7CDYLIDO1ACHE
SCHEMBL7471172 0.77 IDO1 (0.42) KMT2ACBX7CDYLIDO1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7119086-B2 Phenylsulfonyl-1,3-dihydro-2h-indole-2-one derivatives, their preparation and their therapeutic use SANOFI-AVENTIS (FR) 2006-10-10 — — US disclosed
US-20040180878-A1 Phenylsulfonyl-1,3-dihydro-2h-indole-2-one derivatives, their preparation and their therapeutic use SANOFI-AVENTIS (FR) 2004-09-16 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20040180878-A1 Phenylsulfonyl-1,3-dihydro-2h-indole-2-one derivatives, their preparation and their therapeutic use AVPR2, AVPR1A, AVPR1B KMT2A 4309/4885CBX7 4457/4885CDYL 3055/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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