SCHEMBL4873595

SCHEMBL4873595

COc1cccc([C@]2(CNS(C)(=O)=O)CC[C@@H](NC3CCN(C(C)C)CC3)CC2)c1

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SOAT1 P35610 12/20 0.42
F10 P00742 2/20 0.40
MAPT P10636 1/20 0.39
KDM1A O60341 1/20 0.38
VCP P55072 1/20 0.38
NPY1R P25929 1/20 0.37
NPY5R Q15761 1/20 0.37
ALDH1A1 P00352 1/20 0.37
MTNR1A P48039 1/20 0.37
MTNR1B P49286 1/20 0.37

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
SCHEMBL4873608 1.00 SOAT1 (0.42) SOAT1F10MAPTKDM1AVCP
SCHEMBL4880915 0.89 SOAT1 (0.46) SOAT1KDM1ANPY1RNPY5RALDH1A1
SCHEMBL4880910 0.89 SOAT1 (0.46) SOAT1KDM1ANPY1RNPY5RALDH1A1
SCHEMBL4877583 0.84 SIGMAR1 (0.52)
SCHEMBL4877592 0.84 SIGMAR1 (0.52)
SCHEMBL14194844 0.84 HTR2C (0.39) SOAT1KDM1AALDH1A1MTNR1AMTNR1B
Hydrochloric Acid SCHEMBL4873584 0.83 HTR2C (0.40) SOAT1KDM1AALDH1A1MTNR1AMTNR1B
Hydrochloric Acid SCHEMBL4873569 0.83 HTR2C (0.40) SOAT1KDM1AALDH1A1MTNR1AMTNR1B
SCHEMBL4881261 0.83 MCHR1 (0.44) KDM1AALDH1A1
SCHEMBL4881269 0.83 MCHR1 (0.44) KDM1AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080096922-A1 Novel Sulfonamide derivative DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2008-04-24 US disclosed
EP-1736467-A1 NOVEL SULFONAMIDE DERIVATIVE Dainippon Sumitomo Pharma Co., Ltd. (JP) 2006-12-27 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-20080096922-A1 Novel Sulfonamide derivative NR4A1, NR4A2, NR4A3 SOAT1 502/4885F10 2873/4885MAPT 4852/4885

“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.