SCHEMBL30490333

SCHEMBL30490333

CC(C)(C)OC(=O)N1CC2(CC(Oc3cc(C(F)(F)F)c(C(F)(F)F)cn3)C2)C1

nearest known ligand 0.45

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ P2RX3 P56373 1/20 0.45
▸ P2RX2 Q9UBL9 1/20 0.45
▸ PIK3CA P42336 1/20 0.42
▸ ABHD6 Q9BV23 7/20 0.42
▸ GPR119 Q8TDV5 7/20 0.42
▸ MGLL Q99685 3/20 0.40
▸ LOXL2 Q9Y4K0 2/20 0.39
▸ ALK Q9UM73 2/20 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
SCHEMBL23850574 0.85 ABHD6 (0.41) P2RX3P2RX2ABHD6MGLLLOXL2
SCHEMBL23850304 0.83 HSD11B1 (0.47) P2RX3P2RX2ABHD6GPR119MGLL
SCHEMBL30490316 0.80 ABHD6 (0.40) P2RX3P2RX2ABHD6GPR119MGLL
SCHEMBL26631358 0.80 GPR119 (0.46) P2RX3P2RX2ABHD6GPR119MGLL
SCHEMBL29497063 0.79 LOXL2 (0.46) P2RX3P2RX2ABHD6GPR119MGLL
SCHEMBL25297104 0.79 LOXL2 (0.46) P2RX3P2RX2ABHD6GPR119MGLL
SCHEMBL20129206 0.78 DGAT1 (0.55) P2RX3P2RX2ABHD6GPR119
SCHEMBL25255551 0.77 GPR119 (0.45) P2RX3P2RX2ABHD6GPR119MGLL
SCHEMBL30395790 0.77 GPR119 (0.45) P2RX3P2RX2ABHD6GPR119MGLL
SCHEMBL31171162 0.77 GPR119 (0.43) P2RX3P2RX2ABHD6GPR119MGLL

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-12577257-B2 Heterocyclic compounds HOFFMANN-LA ROCHE INC. (US) 2026-03-17 — — US disclosed
EP-3883936-B1 NEW HETEROCYCLIC COMPOUNDS HOFFMANN LA ROCHE (CH) 2023-07-12 — — EP 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-12577257-B2 Heterocyclic compounds H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, CBR1, CBR3 P2RX3 1119/4885P2RX2 951/4885PIK3CA 2763/4885

“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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