SCHEMBL30031950

SCHEMBL30031950

COc1cc(OC(F)F)c2nc3c(n2c1)C[C@H](C(C)(C)C)c1cc(C(=O)O)c(=O)[nH]c1-3

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ POLB P06746 1/20 0.32
▸ GAA P10253 1/20 0.32
▸ PDE9A O76083 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
SCHEMBL30031695 1.00 KDM4E (0.32) KDM4EALDH1A1POLBGAAPDE9A
SCHEMBL30031721 1.00 KDM4E (0.32) KDM4EALDH1A1POLBGAAPDE9A
SCHEMBL30030847 0.95 — —
SCHEMBL30031286 0.95 — —
SCHEMBL30031614 0.95 — —
SCHEMBL30031308 0.94 IDH1 (0.31) —
SCHEMBL30031474 0.94 IDH1 (0.31) —
SCHEMBL30030840 0.94 IDH1 (0.31) —
SCHEMBL30030855 0.92 KDM4E (0.34) KDM4EALDH1A1POLBGAA
SCHEMBL30030778 0.90 — —

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-2022214937-A1 SUBSTITUTED TETRACYCLIC CARBOXYLIC ACIDS, ANALOGUES THEREOF, AND METHODS USING SAME ARBUTUS BIOPHARMA CORPORATION (CA) 2022-10-13 — — WO claimed
WO-2022214937-A1 SUBSTITUTED TETRACYCLIC CARBOXYLIC ACIDS, ANALOGUES THEREOF, AND METHODS USING SAME ARBUTUS BIOPHARMA CORPORATION (CA) 2022-10-13 — — WO disclosed
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