SCHEMBL1004964

SCHEMBL1004964

CS(=O)(=O)N1CCN(Cc2ccc(OC3CCNCC3)cc2)CC1

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 11/20 0.49
RORC P51449 2/20 0.48
RECQL P46063 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
HRH1 P35367 1/20 0.48
ALDH1A1 P00352 2/20 0.46
KDM4E B2RXH2 1/20 0.46
MEN1 O00255 1/20 0.44
ADRB2 P07550 1/20 0.44
KMT2A Q03164 1/20 0.44
UTS2R Q9UKP6 1/20 0.44

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
SCHEMBL12239155 0.88 HRH3 (0.55) HRH3RORCRECQLSMN1; SMN2ALDH1A1
SCHEMBL12263204 0.84 UTS2R (0.57) UTS2R
SCHEMBL12262486 0.83 MLNR (0.47) HRH3KDM4EMEN1KMT2A
SCHEMBL12264952 0.83 UTS2R (0.48) UTS2R
SCHEMBL1005823 0.82 ALDH1A1 (0.53) HRH3RORCRECQLSMN1; SMN2ALDH1A1
SCHEMBL5207756 0.80 HRH3 (0.65) HRH3HRH1ALDH1A1MEN1ADRB2
SCHEMBL21139770 0.80 HRH3 (0.56) HRH3SMN1; SMN2HRH1MEN1ADRB2
SCHEMBL12262492 0.80 UTS2R (0.43) UTS2R
SCHEMBL5202557 0.78 HRH3 (0.67) HRH3SMN1; SMN2HRH1
SCHEMBL12239153 0.78 GPR119 (0.60) HRH3ALDH1A1KDM4EMEN1ADRB2

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-20110263557-A1 COMPOUNDS AND COMPOSITIONS AS MODULATORS OF GPR119 ACTIVITY IRM LLC (BM) 2011-10-27 US disclosed
US-20110263557-A1 COMPOUNDS AND COMPOSITIONS AS MODULATORS OF GPR119 ACTIVITY IRM LLC (BM) 2011-10-27 US disclosed
US-20110263557-A1 COMPOUNDS AND COMPOSITIONS AS MODULATORS OF GPR119 ACTIVITY IRM LLC (BM) 2011-10-27 US disclosed
EP-2271619-A1 COMPOUNDS AND COMPOSITIONS AS MODULATORS OF GPR119 ACTIVITY IRM LLC (BM) 2011-01-12 EP disclosed
WO-2009126535-A1 COMPOUNDS AND COMPOSITIONS AS MODULATORS OF GPR119 ACTIVITY IRM LLC (BM) 2009-10-15 WO 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-20110263557-A1 COMPOUNDS AND COMPOSITIONS AS MODULATORS OF GPR119 ACTIVITY GPR119, GPR55, NR1H2 HRH3 250/4885RORC 229/4885RECQL 3680/4885

“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.