SCHEMBL6075733

SCHEMBL6075733

CC(=O)NC1Cc2coc3ccc(SC4C=CCCC4)c(c23)C1

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 4/20 0.33
MTNR1B P49286 4/20 0.33
CA1 P00915 3/20 0.31
CA2 P00918 3/20 0.31
CA12 O43570 2/20 0.31
CA7 P43166 2/20 0.31
CA14 Q9ULX7 2/20 0.31
CA9 Q16790 1/20 0.30

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
SCHEMBL6076582 0.74 CA1 (0.41) MTNR1AMTNR1BCA1CA2CA12
SCHEMBL6087427 0.59 MTNR1A (0.38) MTNR1AMTNR1BCA1CA2CA12
SCHEMBL30595323 0.57 MTNR1A (0.77) MTNR1AMTNR1BCA1CA2CA12
SCHEMBL1029693 0.57 MTNR1A (0.77) MTNR1AMTNR1BCA1CA2CA12
SCHEMBL6561841 0.56 CXCR2 (0.40) MTNR1AMTNR1B
SCHEMBL17791727 0.55 ALDH1A1 (0.40) MTNR1AMTNR1BCA1CA2CA12
SCHEMBL8548336 0.55 CA1 (0.51) MTNR1AMTNR1BCA1CA2CA12
SCHEMBL6081151 0.54 CA1 (0.43) MTNR1AMTNR1BCA1CA2CA12
SCHEMBL8406961 0.54 MTNR1A (0.57) MTNR1AMTNR1BCA1CA2CA12
SCHEMBL23230039 0.54 MTNR1A (0.53) MTNR1AMTNR1BCA1CA2CA12

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 4 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-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 MTNR1A 465/4885MTNR1B 414/4885CA1 2119/4885
US-20050124682-A1 Substituted cyclic compounds CCNY, CCNT2, TECR MTNR1A 465/4885MTNR1B 414/4885CA1 2119/4885

“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.