SCHEMBL30898043

SCHEMBL30898043

COC(=C=O)/C=C/CN1CC2(CCN(C(=O)OC(C)(C)C)CC2(F)F)C1

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ GPR183 P32249 1/20 0.32
▸ HDAC2 Q92769 1/20 0.31
▸ RORC P51449 1/20 0.30
▸ USP30 Q70CQ3 1/20 0.30

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
SCHEMBL30898190 0.92 — —
SCHEMBL30898060 0.90 — —
SCHEMBL30898045 0.85 SCD5 (0.36) GPR183HDAC2RORC
SCHEMBL30898144 0.85 RORC (0.38) GPR183HDAC2RORC
SCHEMBL30898090 0.83 CYP11B2 (0.39) GPR183HDAC2RORC
SCHEMBL30898219 0.82 CYP2D6 (0.38) HDAC2RORC
SCHEMBL30898235 0.82 SCD5 (0.38) GPR183HDAC2RORC
SCHEMBL30898156 0.82 CYP2D6 (0.41) —
SCHEMBL30898071 0.82 RORC (0.34) GPR183HDAC2RORC
SCHEMBL30898215 0.81 GPR183 (0.37) GPR183HDAC2RORC

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
WO-2024083086-A1 BICYCLIC DERIVATIVE INTEGRIN INHIBITOR 上海如凌生物医药有限公司 2024-04-25 — — WO disclosed
CN-117903171-A Integrin inhibitors of a class of bicyclic derivatives 上海如凌生物医药有限公司 2024-04-19 — — CN disclosed
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