SCHEMBL6183679

SCHEMBL6183679

CC(C)(C)OC(=O)N1CCN(c2nc(COc3ccc(C(=O)N(C(=O)NCC#N)C4CCCCC4)cc3)cs2)CC1

nearest known ligand 0.43

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 16/20 0.43
F2RL3 Q96RI0 1/20 0.38
CTSB P07858 3/20 0.38
CTSS P25774 3/20 0.38
CTSK P43235 1/20 0.38
CTSL P07711 2/20 0.37

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
SCHEMBL6184273 0.87 CTSB (0.49) GPR119CTSBCTSSCTSKCTSL
SCHEMBL6185231 0.83 GPR119 (0.40) GPR119F2RL3CTSBCTSSCTSK
SCHEMBL6183676 0.80 CTSB (0.60) CTSBCTSSCTSKCTSL
SCHEMBL6182175 0.78 GPR119 (0.51) GPR119F2RL3
SCHEMBL6183227 0.78 GPR119 (0.52) GPR119F2RL3
SCHEMBL6182683 0.78 GPR119 (0.45) GPR119
SCHEMBL6185234 0.76 GPR119 (0.40) GPR119F2RL3CTSBCTSSCTSK
SCHEMBL7586450 0.75 GPR119 (0.41) GPR119F2RL3
SCHEMBL7429753 0.74 MAPK1 (0.45) GPR119CTSBCTSSCTSKCTSL
SCHEMBL19850471 0.73 GPR119 (0.49) GPR119F2RL3

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
EP-1161415-B1 N-CYANOMETHYLAMIDES AS PROTEASE INHIBITORS AXYS PHARM INC (US) 2005-07-13 EP disclosed
US-6476026-B1 Compounds and compositions as protease inhibitors AXYS PHARMACEUTICALS, INC. 2002-11-05 US disclosed
US-20020086996-A1 Novel compounds and compositions as protease inhibitors AXYS PHARMACEUTICALS, INC. (US) 2002-07-04 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-20020086996-A1 Novel compounds and compositions as protease inhibitors CTRL, SERPINB1, CPN1 GPR119 4611/4885F2RL3 232/4885CTSB 11/4885

“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.