SCHEMBL27349818

SCHEMBL27349818

C[C@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1n1c(S(C)(=O)=O)nc2ccccc21

nearest known ligand 0.45

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ OPRM1 P35372 3/20 0.45
▸ OGFRL1 Q5TC84 3/20 0.45
▸ OPRD1 P41143 2/20 0.45
▸ OPRK1 P41145 2/20 0.45
▸ GPR119 Q8TDV5 11/20 0.41
▸ USP30 Q70CQ3 3/20 0.41
▸ CCR5 P51681 1/20 0.41
▸ STS P08842 1/20 0.40

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
SCHEMBL27349808 0.87 GPR119 (0.42) GPR119USP30STS
SCHEMBL27349825 0.87 GPR119 (0.42) GPR119
SCHEMBL31727646 0.87 GPR119 (0.42) GPR119USP30STS
SCHEMBL27349793 0.87 GPR119 (0.42) GPR119USP30STS
SCHEMBL27349821 0.87 STS (0.42) GPR119USP30STS
SCHEMBL27349835 0.86 OPRM1 (0.57) OPRM1OGFRL1OPRD1OPRK1GPR119
SCHEMBL31634398 0.86 CYP1A2 (0.38) OPRM1OGFRL1OPRD1OPRK1
SCHEMBL27349842 0.86 GPR119 (0.41) GPR119USP30STS
SCHEMBL27349830 0.85 STS (0.46) GPR119USP30STS
SCHEMBL27351552 0.80 CYP1A2 (0.37) OPRM1OGFRL1OPRD1OPRK1

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-20240208997-A1 CYCLIC BENZIMIDAZOLE DERIVATIVES AS CGAS INHIBITORS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2024-06-27 — — US disclosed
US-20240208997-A1 CYCLIC BENZIMIDAZOLE DERIVATIVES AS CGAS INHIBITORS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2024-06-27 — — 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 (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-20240208997-A1 CYCLIC BENZIMIDAZOLE DERIVATIVES AS CGAS INHIBITORS CGAS, STING1, IFNAR1 OPRM1 4336/4885OGFRL1 4314/4885OPRD1 2405/4885

“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.

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