SCHEMBL5644377

SCHEMBL5644377

CC(C(N)=O)N(C(=O)Cc1cc(F)cc(F)c1)[C@@H]1C(=O)Nc2ccccc2S[C@@H]1c1cc(Br)cs1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
PKM P14618 1/20 0.34
TP53 P04637 1/20 0.34
KDM4E B2RXH2 2/20 0.33
HSD17B10 Q99714 4/20 0.33
TSHR P16473 1/20 0.33
HTT P42858 2/20 0.32
GLA P06280 1/20 0.32
USP2 O75604 1/20 0.32
ESR1 P03372 1/20 0.32
POLB P06746 1/20 0.32
THRB P10828 1/20 0.32
HPGD P15428 1/20 0.32
ALOX15 P16050 1/20 0.32
PTPN7 P35236 1/20 0.32
RECQL P46063 1/20 0.32
ESR2 Q92731 1/20 0.32
CTDSP1 Q9GZU7 1/20 0.32

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
SCHEMBL3343539 1.00 MEN1 (0.34) MEN1KMT2ASMN1; SMN2PKMTP53
SCHEMBL3346682 0.90 TP53 (0.34) MEN1KMT2ASMN1; SMN2PKMTP53
SCHEMBL3343010 0.84 HTT (0.41) MEN1KMT2APKMTP53KDM4E
SCHEMBL3341599 0.84 KMT2A (0.35) MEN1KMT2APKMTP53KDM4E
SCHEMBL3347326 0.84 HTT (0.36) MEN1KMT2APKMTP53KDM4E
SCHEMBL3342757 0.83 MAPT (0.37) MEN1KMT2APKMTP53KDM4E
SCHEMBL3343058 0.80 TRPV1 (0.34) KDM4EHSD17B10HTTUSP2ESR1
SCHEMBL3340837 0.78 KDM4E (0.37) MEN1KMT2ASMN1; SMN2PKMTP53
SCHEMBL3345256 0.78 HSD17B10 (0.47) MEN1KMT2ASMN1; SMN2PKMKDM4E
SCHEMBL3347303 0.78 HSD17B10 (0.41) MEN1KMT2ASMN1; SMN2PKMTP53

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-7294622-B2 Lactams and uses thereof ASTRAZENECA AB (SE) 2007-11-13 US claimed
US-20060089346-A1 Novel lactams and uses thereof ASTRAZENECA AB (SE) 2006-04-27 US claimed

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-20060089346-A1 Novel lactams and uses thereof BACE1, BACE2, APH1B MEN1 1947/4885KMT2A 4442/4885SMN1; SMN2 563/4885

“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.