SCHEMBL1869077

SCHEMBL1869077

CC(=O)NCC1COCSC1

nearest known ligand 0.36

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FUCA1 P04066 1/20 0.36
MTNR1A P48039 7/20 0.35
MTNR1B P49286 4/20 0.33
CACNA1H O95180 1/20 0.33
ALOX15 P16050 1/20 0.31
GLA P06280 1/20 0.31

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
SCHEMBL13854076 0.79
SCHEMBL1869079 0.76 MTNR1A (0.37) FUCA1MTNR1AMTNR1BCACNA1HALOX15
SCHEMBL22519879 0.76
SCHEMBL15461404 0.76 FUCA1 (0.41) FUCA1MTNR1AMTNR1BCACNA1HALOX15
SCHEMBL1865707 0.76 FUCA1 (0.41) FUCA1MTNR1AMTNR1BCACNA1HALOX15
SCHEMBL1863703 0.75 FUCA1 (0.38) FUCA1MTNR1AGLA
SCHEMBL31678251 0.73 NAMPT (0.40) FUCA1MTNR1ACACNA1H
SCHEMBL15461396 0.73 NAMPT (0.40) FUCA1MTNR1ACACNA1H
SCHEMBL15492739 0.70 NAMPT (0.43) FUCA1MTNR1ACACNA1H
SCHEMBL1862996 0.69 ATM (0.36) MTNR1AMTNR1B

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-RE43858-E1 Substituted cycloalkene derivative DAIICHI SANKYO COMPANY, LIMITED (JP) 2012-12-11 US disclosed
US-7935835-B2 Substituted cycloalkene derivative DAIICHI SANKYO COMPANY, LIMITED (JP) 2011-05-03 US disclosed
US-20090233952-A1 SUBSTITUTED CYCLOALKENE DERIVATIVE DAIICHI SANKYO COMPANY, LIMITED (JP) 2009-09-17 US disclosed
EP-1935879-A1 SUBSTITUTED CYCLOALKENE DERIVATIVE Daiichi Sankyo Company, Limited (JP) 2008-06-25 EP 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-20090233952-A1 SUBSTITUTED CYCLOALKENE DERIVATIVE CD40, LITAF, TNF FUCA1 1655/4885MTNR1A 2515/4885MTNR1B 2329/4885

“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.