SCHEMBL6076053

SCHEMBL6076053

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

nearest known ligand 0.54

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 1/20 0.54
NFE2L2 Q16236 1/20 0.54
MTNR1A P48039 10/20 0.54
MTNR1B P49286 4/20 0.54
MAPT P10636 1/20 0.50
CYP2A6 P11509 2/20 0.49
CA2 P00918 1/20 0.47
PKM P14618 1/20 0.46

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
SCHEMBL6075828 0.86 MTNR1A (0.55) MTNR1AMTNR1B
SCHEMBL6077054 0.85 MTNR1A (0.54) MTNR1AMTNR1BCYP2A6CA2
SCHEMBL4323833 0.84 KEAP1 (0.63) KEAP1NFE2L2MTNR1AMTNR1BMAPT
SCHEMBL6076677 0.83 MTNR1A (0.72) KEAP1NFE2L2MTNR1AMTNR1BMAPT
SCHEMBL9121553 0.82 MTNR1A (0.74) MTNR1AMTNR1B
SCHEMBL7018052 0.81 MTNR1A (0.64) MTNR1AMTNR1B
SCHEMBL6075758 0.81 MTNR1A (0.56) KEAP1NFE2L2MTNR1AMTNR1BMAPT
SCHEMBL6076266 0.81 KEAP1 (0.56) KEAP1NFE2L2MTNR1AMTNR1BMAPT
SCHEMBL4322784 0.80 MAPT (0.48) KEAP1NFE2L2MTNR1AMTNR1BMAPT
SCHEMBL27730132 0.80 MTNR1A (0.52) KEAP1NFE2L2MTNR1AMTNR1BMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7126012-B2 Substituted cyclic compounds LES LABORATOIRES SERVIER (FR) 2006-10-24 US disclosed
US-7115752-B2 Substituted cyclic compounds LES LABORATOIRES SERVIER (FR) 2006-10-03 US disclosed
US-20050124682-A1 Substituted cyclic compounds LESIEUR DANIEL (FR) 2005-06-09 US disclosed
US-6872851-B1 Substituted cyclic compounds, preparation method and pharmaceutical compositions containing them LES LABORATORIES SERVIER (FR) 2005-03-29 US disclosed
US-20050059729-A1 Substituted cyclic compounds LESIEUR DANIEL (FR) 2005-03-17 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-20050059729-A1 Substituted cyclic compounds CCNY, CCNT2, TECR KEAP1 1708/4885NFE2L2 2066/4885MTNR1A 465/4885
US-20050124682-A1 Substituted cyclic compounds CCNY, CCNT2, TECR KEAP1 1708/4885NFE2L2 2066/4885MTNR1A 465/4885

“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.