SCHEMBL13615451

SCHEMBL13615451

CC(=NO)c1cc(Cl)c(N)c(Cl)c1

nearest known ligand 0.59

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 2/20 0.42
▸ MEN1 O00255 2/20 0.42
▸ KMT2A Q03164 2/20 0.42
▸ NPSR1 Q6W5P4 1/20 0.42
▸ ALDH1A1 P00352 1/20 0.42
▸ CYP3A4 P08684 1/20 0.42
▸ CA9 Q16790 2/20 0.41
▸ NPFFR2 Q9Y5X5 1/20 0.39
▸ HSD11B1 P28845 5/20 0.38
▸ FURIN P09958 1/20 0.35
▸ POLB P06746 1/20 0.35
▸ CASP3 P42574 1/20 0.35
▸ GFER P55789 1/20 0.35
▸ SENP8 Q96LD8 1/20 0.35
▸ SENP7 Q9BQF6 1/20 0.35
▸ SENP6 Q9GZR1 1/20 0.35
▸ THRB P10828 1/20 0.34

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
SCHEMBL8242887 1.00 SMN1; SMN2 (0.42) SMN1; SMN2MEN1KMT2ANPSR1ALDH1A1
SCHEMBL3456181 0.76 ALDH1A1 (0.44) KMT2AALDH1A1CYP3A4CA9HSD11B1
SCHEMBL3456178 0.76 ALDH1A1 (0.44) KMT2AALDH1A1CYP3A4CA9HSD11B1
SCHEMBL11318302 0.75 NPSR1 (0.56) SMN1; SMN2MEN1KMT2ANPSR1ALDH1A1
SCHEMBL8661356 0.75 KMT2A (0.47) SMN1; SMN2MEN1KMT2ANPSR1ALDH1A1
SCHEMBL7622154 0.75 KMT2A (0.47) SMN1; SMN2MEN1KMT2ANPSR1ALDH1A1
SCHEMBL3228942 0.74 NPFFR2 (0.61) SMN1; SMN2MEN1KMT2AALDH1A1CYP3A4
SCHEMBL7537876 0.74 NPFFR2 (0.61) SMN1; SMN2MEN1KMT2AALDH1A1CYP3A4
SCHEMBL2866567 0.73 HSD11B1 (0.48) ALDH1A1CYP3A4CA9HSD11B1
SCHEMBL14415900 0.73 ALDH1A1 (0.46) ALDH1A1CYP3A4CA9NPFFR2HSD11B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7612069-B2 Acyl guanidines as beta-secretase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2009-11-03 — — US disclosed
US-7273882-B2 Aminoacetamide acyl guanidines as β-secretase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2007-09-25 — — US disclosed
US-20070015754-A1 Acyl guanidines as beta-secretase inhibitors BRISTOL-MYERS SQUIBB COMPANY 2007-01-18 — — 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-20070015754-A1 Acyl guanidines as beta-secretase inhibitors BACE1, APP, BACE2 SMN1; SMN2 630/4885MEN1 3522/4885KMT2A 3022/4885

“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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