SCHEMBL16662462

SCHEMBL16662462

CC(C)(C)OC(=O)N1CC(C(O)c2ccnc(CF)c2)C1

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ IDO1 P14902 1/20 0.41
▸ PDE4B Q07343 3/20 0.36
▸ DPP4 P27487 1/20 0.36
▸ USP30 Q70CQ3 2/20 0.36
▸ GPR119 Q8TDV5 2/20 0.36
▸ LIPE Q05469 1/20 0.36
▸ NAMPT P43490 1/20 0.36
▸ AOC3 Q16853 1/20 0.36
▸ MAP3K14 Q99558 2/20 0.36
▸ NR1H2 P55055 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
SCHEMBL16650986 0.83 IDO1 (0.40) IDO1PDE4BUSP30GPR119LIPE
SCHEMBL16662458 0.78 USP30 (0.41) USP30GPR119NAMPTAOC3NR1H2
SCHEMBL20164090 0.77 DPP4 (0.45) IDO1PDE4BDPP4USP30GPR119
SCHEMBL20164106 0.75 DPP4 (0.42) IDO1PDE4BDPP4USP30GPR119
SCHEMBL19734488 0.75 DPP4 (0.42) IDO1PDE4BDPP4USP30GPR119
SCHEMBL23211978 0.75 HDAC1 (0.46) IDO1PDE4BDPP4USP30GPR119
SCHEMBL19734489 0.75 DPP4 (0.42) IDO1PDE4BDPP4USP30GPR119
SCHEMBL21384664 0.75 HDAC1 (0.46) IDO1PDE4BDPP4USP30GPR119
SCHEMBL25199634 0.75 RORC (0.48) IDO1USP30GPR119NAMPT
SCHEMBL3032608 0.75 NPC1 (0.43) IDO1PDE4B

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-9624225-B2 Quinolinyl modulators of RORγt JANSSEN PHARMACEUTICA NV (BE) 2017-04-18 — — US disclosed
US-20150111870-A1 QUINOLINYL MODULATORS OF RORyt JOHNSON & JOHNSON (US) 2015-04-23 — — 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-20150111870-A1 QUINOLINYL MODULATORS OF RORyt RORC, RORA, RORB IDO1 456/4885PDE4B 742/4885DPP4 3721/4885

“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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