SCHEMBL22980435

SCHEMBL22980435

CC(C)(C)OC(=O)N1CCC2(CC1)Oc1cccnc1C2=O

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.47
GPR119 Q8TDV5 7/20 0.44
DTYMK P23919 1/20 0.44
OPRD1 P41143 1/20 0.42
OPRK1 P41145 1/20 0.42
ACACB O00763 1/20 0.40
EPHX2 P34913 1/20 0.40
CKS1B P61024 1/20 0.40
SKP1 P63208 1/20 0.40
SKP2 Q13309 1/20 0.40
NAMPT P43490 1/20 0.39
DDB1 Q16531 1/20 0.39
CRBN Q96SW2 1/20 0.39
GRM5 P41594 1/20 0.39
SCD5 Q86SK9 1/20 0.38
AVPR1A P37288 1/20 0.38

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
SCHEMBL2588219 0.86 POLB (0.43) POLBGPR119DTYMKOPRD1OPRK1
SCHEMBL12180668 0.86 POLB (0.43) POLBGPR119DTYMKOPRD1OPRK1
SCHEMBL3491735 0.83 EPHX2 (0.55) POLBGPR119DTYMKACACBEPHX2
SCHEMBL12180379 0.83 POLB (0.44) POLBGPR119DTYMKOPRD1OPRK1
SCHEMBL22402186 0.82 POLB (0.47) POLBGPR119DTYMKOPRD1OPRK1
SCHEMBL31288587 0.82 POLB (0.47) POLBGPR119DTYMKOPRD1OPRK1
SCHEMBL23001546 0.82 POLB (0.44) POLBGPR119DTYMKOPRD1OPRK1
SCHEMBL21397530 0.81 HDAC3 (0.45) GPR119SCD5
SCHEMBL29626684 0.80 NPC1 (0.45) POLBGPR119DTYMKOPRD1OPRK1
SCHEMBL10286651 0.79 HSD11B1 (0.46) POLBGPR119DTYMKSCD5AVPR1A

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 4199/4885GPR119 965/4885DTYMK 1314/4885

“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.