SCHEMBL3249183

SCHEMBL3249183

O=C(Cc1ccccc1NC1(Cc2cccc(Cl)c2)C(=O)Nc2cc(Cl)ccc21)N1CCN(CCO)CC1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MDM2 Q00987 4/20 0.50
▸ TP53 P04637 3/20 0.42
▸ ATM Q13315 1/20 0.41
▸ HTR1A P08908 3/20 0.37
▸ HTR7 P34969 2/20 0.37
▸ MEN1 O00255 3/20 0.37
▸ KMT2A Q03164 3/20 0.37
▸ GHSR Q92847 1/20 0.37
▸ TSHR P16473 1/20 0.36
▸ ALDH1A1 P00352 2/20 0.36
▸ LMNA P02545 2/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ PTGDR2 Q9Y5Y4 1/20 0.35
▸ NPSR1 Q6W5P4 1/20 0.35
▸ CCR3 P51677 1/20 0.35

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
SCHEMBL3239223 0.95 MDM2 (0.49) MDM2TP53ATMHTR1AHTR7
SCHEMBL3247649 0.89 MDM2 (0.53) MDM2TP53ATMMEN1KMT2A
SCHEMBL1320652 0.87 MDM2 (0.54) MDM2TP53HTR1AHTR7MEN1
SCHEMBL3239017 0.87 MDM2 (0.51) MDM2TP53ATMMEN1KMT2A
SCHEMBL1322368 0.85 MDM2 (0.54) MDM2TP53HTR1AHTR7MEN1
SCHEMBL3253003 0.84 MDM2 (0.50) MDM2TP53ATMMEN1KMT2A
SCHEMBL3250920 0.81 MDM2 (0.62) MDM2TP53KMT2A
SCHEMBL1322062 0.81 MDM2 (0.54) MDM2TP53HTR1AHTR7MEN1
SCHEMBL1320368 0.80 MDM2 (0.57) MDM2TP53HTR1AHTR7KMT2A
SCHEMBL1319791 0.79 MDM2 (0.47) MDM2TP53LMNANPSR1

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
EP-2066318-B1 OXINDOLE DERIVATIVES AS ANTICANCER AGENTS HOFFMANN LA ROCHE (CH) 2010-05-12 — — EP claimed
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