SCHEMBL6076079

SCHEMBL6076079

CC(=O)NCCc1c(Cc2ccc(F)cc2)n(C)c2ncc(SCc3ccc(C(F)(F)F)cc3)cc12

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PLA2G7 Q13093 3/20 0.41
MTNR1A P48039 5/20 0.36
MTNR1B P49286 5/20 0.36
PTGDR2 Q9Y5Y4 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.34
RORC P51449 1/20 0.34
NPC1 O15118 2/20 0.34
RAB9A P51151 2/20 0.34
MAPT P10636 2/20 0.34
THRB P10828 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
TP53 P04637 1/20 0.33
VNN1 O95497 1/20 0.33
ABCB1 P08183 1/20 0.33

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
SCHEMBL5344485 0.81 MTNR1A (0.43) MTNR1AMTNR1BNPC1RAB9AMAPT
SCHEMBL5335717 0.80 MTNR1A (0.40) MTNR1AMTNR1BSMN1; SMN2NPC1RAB9A
SCHEMBL5336253 0.80 CNR2 (0.41) MTNR1AMTNR1BPTGDR2NPC1RAB9A
SCHEMBL6075849 0.80 MTNR1A (0.40) MTNR1AMTNR1BSMN1; SMN2NPC1RAB9A
SCHEMBL5340639 0.80 MTNR1A (0.40) MTNR1AMTNR1BSMN1; SMN2NPC1RAB9A
SCHEMBL8137801 0.78 MTNR1A (0.54) MTNR1AMTNR1BSMN1; SMN2
SCHEMBL6076333 0.77 MTNR1A (0.38) MTNR1AMTNR1BNPC1RAB9AMEN1
SCHEMBL6076336 0.77 MTNR1A (0.38) MTNR1AMTNR1BNPC1RAB9AMEN1
SCHEMBL5351402 0.76 MTNR1A (0.39) MTNR1AMTNR1BNPC1RAB9AMAPT
SCHEMBL6076938 0.74 MTNR1A (0.41) MTNR1AMTNR1BMEN1KMT2AL3MBTL1

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 PLA2G7 3164/4885MTNR1A 465/4885MTNR1B 414/4885
US-20050124682-A1 Substituted cyclic compounds CCNY, CCNT2, TECR PLA2G7 3164/4885MTNR1A 465/4885MTNR1B 414/4885

“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.