SCHEMBL31228339

SCHEMBL31228339

CC(C)(C)OC(=O)N1CC[C@H](CO)[C@H]1COCc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KLK7 P49862 1/20 0.46
GPR119 Q8TDV5 2/20 0.42
JAK2 O60674 1/20 0.41
JAK1 P23458 1/20 0.41
STS P08842 1/20 0.41
HCRTR2 O43614 1/20 0.41
PARP1 P09874 1/20 0.40
KDM4E B2RXH2 1/20 0.39
PKM P14618 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
GRM5 P41594 2/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
DPP4 P27487 1/20 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
SCHEMBL31153726 0.92 KLK7 (0.46) KLK7GPR119JAK2JAK1STS
SCHEMBL7301938 0.86 KLK7 (0.47) KLK7GPR119JAK2JAK1STS
SCHEMBL31228495 0.85 KLK7 (0.46) KLK7GPR119JAK2JAK1STS
SCHEMBL31228337 0.85 KLK7 (0.46) KLK7GPR119JAK2JAK1STS
SCHEMBL31228493 0.85 KLK7 (0.46) KLK7GPR119JAK2JAK1STS
SCHEMBL31228447 0.84 KLK7 (0.48) KLK7GPR119JAK2JAK1STS
SCHEMBL31228705 0.84 KLK7 (0.48) KLK7GPR119JAK2JAK1STS
SCHEMBL31153774 0.83 KLK7 (0.44) KLK7GPR119JAK2JAK1STS
SCHEMBL7921498 0.82 KLK7 (0.47) KLK7GPR119JAK2JAK1STS
SCHEMBL7921496 0.82 KLK7 (0.47) KLK7GPR119JAK2JAK1STS

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-4688789-A1 MACROCYCLIC RAS INHIBITORS Revolution Medicines, Inc. (US) 2026-02-11 EP disclosed
WO-2024211663-A9 MACROCYCLIC RAS INHIBITORS Revolution Medicines, Inc. (US) 2025-01-30 WO disclosed
WO-2024211663-A1 CONDENSED MACROCYCLIC COMPOUNDS AS RAS INHIBITORS Revolution Medicines, Inc. (US) 2024-10-10 WO disclosed