SCHEMBL4322784

SCHEMBL4322784

O=C(NCCc1csc2ccc(Cl)cc12)c1ccccc1C(F)(F)F

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.48
SNCA P37840 2/20 0.47
MTNR1A P48039 5/20 0.47
MTNR1B P49286 2/20 0.47
KEAP1 Q14145 1/20 0.46
NFE2L2 Q16236 1/20 0.46
CNR1 P21554 1/20 0.45
PKM P14618 1/20 0.45
PTGS1 P23219 2/20 0.43
PTGS2 P35354 1/20 0.43
GRM5 P41594 1/20 0.43
P2RX7 Q99572 1/20 0.42
KDM4E B2RXH2 1/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
TP53 P04637 1/20 0.42

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
SCHEMBL6076053 0.80 KEAP1 (0.54) MAPTMTNR1AMTNR1BKEAP1NFE2L2
SCHEMBL4323833 0.77 KEAP1 (0.63) MAPTMTNR1AMTNR1BKEAP1NFE2L2
SCHEMBL6076677 0.76 MTNR1A (0.72) MAPTMTNR1AMTNR1BKEAP1NFE2L2
SCHEMBL6078133 0.75 LMNA (0.55) MAPTSNCAMTNR1AKEAP1NFE2L2
SCHEMBL3211644 0.75 KMT2A (0.54) CNR1GRM5P2RX7KDM4EMEN1
SCHEMBL6076266 0.74 KEAP1 (0.56) MAPTMTNR1AMTNR1BKEAP1NFE2L2
SCHEMBL6075758 0.74 MTNR1A (0.56) MAPTMTNR1AMTNR1BKEAP1NFE2L2
SCHEMBL6075719 0.73 MAPT (0.57) MAPTKEAP1NFE2L2MEN1KMT2A
SCHEMBL6075722 0.73 MAPT (0.57) MAPTKEAP1NFE2L2MEN1KMT2A
SCHEMBL16760266 0.73 KMT2A (0.48) MAPTCNR1P2RX7MEN1KMT2A

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-20090054235-A1 Benzoheterocyclylethylbenzamide derivatives BAYER CROPSCIENCE AG (DE) 2009-02-26 US disclosed
CN-101223136-A New benzoheterocyclylethylbenzamide derivatives BAYER CROPSCIENCE SA (FR) 2008-07-16 CN 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-20090054235-A1 Benzoheterocyclylethylbenzamide derivatives CYP51A1, CBR3, ERG28 MAPT 3550/4885SNCA 3270/4885MTNR1A 4329/4885

“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.