SCHEMBL31159702

SCHEMBL31159702

COC(=O)c1cc(NC[C@@H]2CCO2)c(N)c(OC2COC2)c1

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 4/20 0.36
▸ PDE4B Q07343 5/20 0.36
▸ PDE4D Q08499 7/20 0.36
▸ PDE4A P27815 4/20 0.36
▸ PDE4C Q08493 4/20 0.36
▸ TDO2 P48775 1/20 0.35
▸ PTGER4 P35408 1/20 0.35
▸ HPGD P15428 2/20 0.34
▸ ALDH1A1 P00352 4/20 0.34
▸ KDM4E B2RXH2 3/20 0.34
▸ HSD17B10 Q99714 1/20 0.34
▸ LRRK2 Q5S007 1/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ MAPT P10636 1/20 0.33

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
SCHEMBL27176929 0.87 KDM4E (0.42) KMT2APTGER4HPGDALDH1A1KDM4E
SCHEMBL27176854 0.86 SLC5A7 (0.36) KMT2ATDO2PTGER4LRRK2
SCHEMBL27205176 0.86 SLC5A7 (0.36) KMT2ATDO2PTGER4LRRK2
SCHEMBL31159781 0.84 ALDH1A1 (0.43) KMT2APDE4BPDE4DPDE4APDE4C
SCHEMBL31160005 0.84 HCAR3 (0.41) KMT2AHPGDALDH1A1KDM4EMEN1
SCHEMBL30966520 0.84 ALDH1A1 (0.47) KMT2APTGER4HPGDALDH1A1KDM4E
SCHEMBL24901946 0.82 PTGER4 (0.43) KMT2ATDO2PTGER4HPGDALDH1A1
SCHEMBL30232663 0.82 PTGER4 (0.43) KMT2ATDO2PTGER4HPGDALDH1A1
SCHEMBL31321908 0.82 KMT2A (0.37) KMT2ATDO2PTGER4HPGDALDH1A1
SCHEMBL27176969 0.82 ALDH1A1 (0.39) KMT2APTGER4HPGDALDH1A1KDM4E

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
EP-4688144-A1 COMPOUNDS AS GLP-1R AGONISTS Terns Pharmaceuticals, Inc. (US) 2026-02-11 — — EP disclosed
WO-2024206878-A1 COMPOUNDS AS GLP-1R AGONISTS TERNS PHARMACEUTICALS, INC. (US) 2024-10-03 — — WO disclosed
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