SCHEMBL6492585

SCHEMBL6492585

CN(Cc1nccn1-c1ccc2c(c1)CCN2C(=O)OC(C)(C)C)S(C)(=O)=O

nearest known ligand 0.53

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
F10 P00742 3/20 0.53
GPR119 Q8TDV5 13/20 0.43
CYP11B2 P19099 1/20 0.37
DHODH Q02127 1/20 0.37
TP53 P04637 1/20 0.36
GAA P10253 1/20 0.36
MPO P05164 1/20 0.36

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
SCHEMBL6506289 0.88 F10 (0.52) F10GPR119CYP11B2DHODHTP53
SCHEMBL6494664 0.84 GPR119 (0.41) F10GPR119CYP11B2DHODHTP53
SCHEMBL5625864 0.77 CYP11B2 (0.41) GPR119CYP11B2DHODHMPO
SCHEMBL30681413 0.74 GPR119 (0.49) GPR119CYP11B2DHODHTP53MPO
SCHEMBL1998284 0.73 F10 (0.43) F10GPR119CYP11B2DHODHMPO
SCHEMBL30681471 0.72 DRD3 (0.46) GPR119DHODHGAA
SCHEMBL24557404 0.71 GPR119 (0.69) GPR119
SCHEMBL5389996 0.69 NOTUM (0.68) GPR119CYP11B2
SCHEMBL8257530 0.69 HTR6 (0.46) GPR119DHODHMPO
SCHEMBL28429340 0.69 GPR119 (0.45) GPR119DHODH

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-6949550-B2 Substituted amino methyl factor Xa inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2005-09-27 US disclosed
US-20030212054-A1 Substituted amino methyl factor Xa inhibitors BRISTOL-MYERS SQUIBB COMPANY 2003-11-13 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 (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-20030212054-A1 Substituted amino methyl factor Xa inhibitors F11, F10, F9 F10 2/4885GPR119 3600/4885CYP11B2 3338/4885

“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.