SCHEMBL4966389

SCHEMBL4966389

NN(C(=O)c1ccc(Br)o1)C(=O)c1cccs1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 6/20 0.58
▸ MEN1 O00255 4/20 0.54
▸ POLB P06746 2/20 0.54
▸ RECQL P46063 1/20 0.54
▸ CTDSP1 Q9GZU7 1/20 0.54
▸ TDP1 Q9NUW8 1/20 0.54
▸ RAB9A P51151 4/20 0.51
▸ NPC1 O15118 3/20 0.51
▸ ALDH1A1 P00352 7/20 0.50
▸ MAPT P10636 4/20 0.50
▸ KDM4E B2RXH2 1/20 0.50
▸ GAA P10253 1/20 0.50
▸ CRHBP P24387 1/20 0.50
▸ HTT P42858 1/20 0.50
▸ CRHR2 Q13324 1/20 0.50
▸ MCOLN3 Q8TDD5 1/20 0.50
▸ LMNA P02545 3/20 0.48
▸ TP53 P04637 2/20 0.48
▸ HPGD P15428 2/20 0.47
▸ SMN1; SMN2 Q16637 4/20 0.44

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
SCHEMBL1861793 0.74 KMT2A (1.00) KMT2AMEN1POLBRECQLCTDSP1
SCHEMBL10441485 0.72 HPGDS (0.58) KMT2AMEN1POLBRAB9ANPC1
SCHEMBL27921277 0.72 CES2 (0.55) KMT2AMEN1POLBTDP1RAB9A
SCHEMBL27921510 0.71 CES2 (0.50) KMT2AMEN1POLBRAB9ANPC1
SCHEMBL28845197 0.70 CES2 (0.64) KMT2AMEN1POLBTDP1RAB9A
SCHEMBL12136717 0.70 KMT2A (1.00) KMT2AMEN1POLBRECQLCTDSP1
SCHEMBL27610864 0.69 CES2 (0.61) KMT2AMEN1POLBTDP1RAB9A
SCHEMBL6653282 0.69 F2 (0.49) KMT2AMEN1POLBTDP1RAB9A
SCHEMBL8457507 0.68 GSK3B (0.56) KMT2AMEN1POLBRAB9ANPC1
Potassium Ion SCHEMBL10701746 0.68 CES2 (0.50) KMT2AMEN1POLBTDP1RAB9A

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-20080188536-A1 Modulation of pathogenicity QUONOVA, LLC 2008-08-07 — — US disclosed
US-20080188491-A1 Modulation of pathogenicity QUONOVA, LLC 2008-08-07 — — 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 (2 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-20080188491-A1 Modulation of pathogenicity NR4A1, MSR1, NR4A2 KMT2A 3525/4885MEN1 2823/4885POLB 3265/4885
US-20080188536-A1 Modulation of pathogenicity NR4A1, NR4A2, NR4A3 KMT2A 3588/4885MEN1 2784/4885POLB 3327/4885

“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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