SCHEMBL22980260

SCHEMBL22980260

CC(C)(C)OC(=O)N1CCC(O)(C2(c3ncccc3F)SCCCS2)CC1

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.43
GRM5 P41594 3/20 0.41
GRM1 Q13255 3/20 0.41
DTYMK P23919 1/20 0.40
GPR119 Q8TDV5 6/20 0.40
OPRD1 P41143 1/20 0.38
OPRK1 P41145 1/20 0.38
RORC P51449 1/20 0.38
TRPV1 Q8NER1 1/20 0.38
KDM1A O60341 1/20 0.38
SCD5 Q86SK9 1/20 0.37
NAMPT P43490 1/20 0.36
MAPT P10636 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP3A5 P20815 1/20 0.36
USP30 Q70CQ3 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
SCHEMBL22389843 0.86 POLB (0.43) POLBGRM5GRM1DTYMKGPR119
SCHEMBL29391168 0.86 POLB (0.43) POLBGRM5GRM1DTYMKGPR119
SCHEMBL22303484 0.84 PDK2 (0.42) GRM5GRM1GPR119RORCKDM1A
SCHEMBL30486491 0.84 PDK2 (0.42) GRM5GRM1GPR119RORCKDM1A
SCHEMBL3787005 0.82 POLB (0.50) POLBGRM5GRM1DTYMKGPR119
SCHEMBL3792634 0.80 TRPV1 (0.54) POLBGRM5GRM1DTYMKGPR119
SCHEMBL21384115 0.78 GPR119 (0.40) GPR119OPRK1RORCSMN1; SMN2
SCHEMBL21383854 0.78 GPR119 (0.35) GPR119SCD5CYP3A4CYP3A5USP30
SCHEMBL1175585 0.77 USP30 (0.40) GPR119RORCUSP30
SCHEMBL22493716 0.77 POLB (0.43) POLBGRM5DTYMKGPR119OPRD1

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-20220289753-A1 SHP2 INHIBITORS IRBM S.P.A. (IT) 2022-09-15 US disclosed
EP-4010335-A1 SHP2 INHIBITORS IRBM S.P.A. (IT) 2022-06-15 EP disclosed
WO-2021028362-A1 SHP2 INHIBITORS IRBM S.P.A. (IT) 2021-02-18 WO disclosed
WO-2021028362-A1 SHP2 INHIBITORS IRBM S.P.A. (IT) 2021-02-18 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-20220289753-A1 SHP2 INHIBITORS PTPN1, PTPN2, PTPN7 POLB 4199/4885GRM5 1734/4885GRM1 1365/4885

“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.