SCHEMBL1609510

SCHEMBL1609510

COC(=O)c1nc(C2CC2)nc(NC(Cc2c[nH]c3ccccc23)C(=O)OC)c1Cl

nearest known ligand 0.61

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 1/20 0.61
▸ KCNA5 P22460 4/20 0.48
▸ KCNH2 Q12809 1/20 0.48
▸ MEN1 O00255 3/20 0.47
▸ KMT2A Q03164 3/20 0.47
▸ HCRTR1 O43613 1/20 0.47
▸ MAPT P10636 2/20 0.46
▸ TP53 P04637 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ BBOX1 O75936 2/20 0.44
▸ NPBWR1 P48145 1/20 0.43
▸ MCHR1 Q99705 1/20 0.43

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
SCHEMBL1609942 0.90 TDP1 (0.49) TDP1KCNA5KCNH2MAPTBBOX1
SCHEMBL1610962 0.88 TDP1 (0.48) TDP1KCNA5KCNH2MAPTBBOX1
SCHEMBL1610959 0.88 TDP1 (0.48) TDP1KCNA5KCNH2MAPTBBOX1
SCHEMBL1609091 0.82 CDK2 (0.47) TDP1MEN1KMT2ASMN1; SMN2
SCHEMBL1610879 0.79 NOS2 (0.38) KMT2A
SCHEMBL1610877 0.79 NOS2 (0.38) KMT2A
SCHEMBL12712978 0.78 P2RX3 (0.39) —
SCHEMBL1609306 0.78 NPSR1 (0.42) KMT2A
SCHEMBL1609177 0.78 NOS2 (0.42) KMT2A
SCHEMBL12712973 0.77 PDE10A (0.37) TDP1MEN1KMT2AMAPT

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-20110086759-A1 CHEMICAL COMPOUNDS SYNGENTA CROP PROTECTION, INC. (US) 2011-04-14 — — US disclosed
WO-2009081112-A2 CHEMICAL COMPOUNDS SYNGENTA LIMITED (GB) 2009-07-02 — — WO 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-20110086759-A1 CHEMICAL COMPOUNDS DDT, PNPO, CBR3 TDP1 344/4885KCNA5 2741/4885KCNH2 2997/4885

“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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