SCHEMBL3833437

SCHEMBL3833437

CS(=O)(=O)O[C@@H]1CN(Cc2ccccc2)C[C@H]1OS(C)(=O)=O

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 1/20 0.48
FUCA1 P04066 2/20 0.47
DRD2 P14416 2/20 0.46
RECQL P46063 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
S1PR1 P21453 1/20 0.45
S1PR5 Q9H228 1/20 0.45
MEN1 O00255 1/20 0.44
CYP2D6 P10635 1/20 0.44
KMT2A Q03164 1/20 0.44
HTR2A P28223 1/20 0.44
SIGMAR1 Q99720 1/20 0.44
LMNA P02545 1/20 0.44
ACHE P22303 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
SCHEMBL10522832 1.00 PTPN1 (0.48) PTPN1FUCA1DRD2RECQLSMN1; SMN2
SCHEMBL13379049 1.00 PTPN1 (0.48) PTPN1FUCA1DRD2RECQLSMN1; SMN2
SCHEMBL13567845 0.92 PTPN1 (0.43) PTPN1FUCA1DRD2RECQLSMN1; SMN2
SCHEMBL15866138 0.91 PTPN1 (0.45) PTPN1FUCA1DRD2RECQLSMN1; SMN2
SCHEMBL9846453 0.91 PTPN1 (0.45) PTPN1FUCA1DRD2RECQLSMN1; SMN2
SCHEMBL5745374 0.91 PTPN1 (0.45) PTPN1FUCA1DRD2RECQLSMN1; SMN2
SCHEMBL18453426 0.90 PTPN1 (0.44) PTPN1FUCA1DRD2RECQLSMN1; SMN2
SCHEMBL4440958 0.90 PTPN1 (0.44) PTPN1FUCA1DRD2RECQLSMN1; SMN2
SCHEMBL22211568 0.87 PTPN1 (0.42) PTPN1FUCA1DRD2RECQLSMN1; SMN2
SCHEMBL6358667 0.87 PTPN1 (0.42) PTPN1FUCA1DRD2RECQLSMN1; SMN2

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-20090312310-A1 Imidazothiazole derivatives DAIICHI SANKYO COMPANY, LIMITED (JP) 2009-12-17 US disclosed
EP-2103619-A1 IMIDAZOTHIAZOLE DERIVATIVES Daiichi Sankyo Company, Limited (JP) 2009-09-23 EP disclosed
US-7485641-B2 Substituted 3-amino-pyrrolidino-4-lactams PFIZER, INC. (US) 2009-02-03 US disclosed
WO-2007148185-A2 SUBSTITUTED 3 -AMINO- PYRROLIDINO-4 -LACTAMS AS DPP INHIBITORS PFIZER PRODUCTS INC. (US) 2007-12-27 WO disclosed
US-20070299076-A1 Substituted 3-Amino-Pyrrolidino-4-Lactams PFIZER INC 2007-12-27 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-20090312310-A1 Imidazothiazole derivatives TP53, MDM2, TP53BP1 PTPN1 1765/4885FUCA1 4824/4885DRD2 3837/4885
US-20070299076-A1 Substituted 3-Amino-Pyrrolidino-4-Lactams PRMT1, PRMT7, PRMT3 PTPN1 1560/4885FUCA1 4528/4885DRD2 2011/4885

“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.