SCHEMBL22644657

SCHEMBL22644657

COCCOc1ccc(N2CCN(C(=O)OC(C)(C)C)CC2)nc1

nearest known ligand 0.64

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 11/20 0.64
RET P07949 4/20 0.61
ME2 P23368 1/20 0.55
ME1 P48163 1/20 0.55
ME3 Q16798 1/20 0.55
DDB1 Q16531 1/20 0.52
CRBN Q96SW2 1/20 0.52
MAP4K4 O95819 1/20 0.51
CKS1B P61024 1/20 0.50
SKP1 P63208 1/20 0.50
SKP2 Q13309 1/20 0.50
HPGD P15428 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47

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
SCHEMBL1109108 0.90 GPR119 (0.65) GPR119RETME2ME1ME3
SCHEMBL16473496 0.87 GPR119 (0.64) GPR119RETME2ME1ME3
SCHEMBL30906326 0.87 GPR119 (0.62) GPR119RETDDB1CRBNMAP4K4
SCHEMBL17107380 0.87 GPR119 (0.62) GPR119RETME2ME1ME3
SCHEMBL31287119 0.85 GPR119 (0.65) GPR119RETDDB1CRBNMAP4K4
SCHEMBL22638144 0.84 ME2 (0.60) GPR119RETME2ME1ME3
SCHEMBL21659187 0.83 MAPT (0.60) GPR119RETDDB1CRBNSMN1; SMN2
SCHEMBL30931813 0.82 GPR119 (0.76) GPR119ME2ME1ME3CKS1B
SCHEMBL1103897 0.82 GPR119 (0.76) GPR119ME2ME1ME3CKS1B
SCHEMBL22581906 0.81 GPR119 (0.60) GPR119RETDDB1CRBNMAP4K4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12325708-B2 Adenosine 2 receptor antagonists NEKTAR THERAPEUTICS (US) 2025-06-10 US disclosed
US-20220235056-A1 ADENOSINE 2 RECEPTOR ANTAGONISTS NEKTAR THERAPEUTICS 2022-07-28 US disclosed
WO-2020227156-A1 ADENOSINE 2 RECEPTOR ANTAGONISTS NEKTAR THERAPEUTICS (US) 2020-11-12 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 (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-20220235056-A1 ADENOSINE 2 RECEPTOR ANTAGONISTS ADORA2A, ADORA2B, ADORA3 GPR119 70/4885RET 237/4885ME2 1300/4885
US-12325708-B2 Adenosine 2 receptor antagonists ADORA2A, ADORA2B, ADORA3 GPR119 70/4885RET 237/4885ME2 1300/4885

“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.