SCHEMBL27124466

SCHEMBL27124466

COC(=O)c1cc(OC)nc(-c2cc3c(cc2OC)CCc2c(C(=O)N(C)C(C)(C)C)nn(-c4cc(Cl)cc(Cl)c4)c2-3)c1

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ RAD52 P43351 1/20 0.37
▸ PDE7A Q13946 1/20 0.36
▸ PDE3A Q14432 1/20 0.36
▸ PDE10A Q9Y233 1/20 0.36
▸ ALDH1A1 P00352 2/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ IKBKB O14920 1/20 0.30
▸ POLB P06746 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ NPSR1 Q6W5P4 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
SCHEMBL30759552 1.00 RAD52 (0.37) RAD52PDE7APDE3APDE10AALDH1A1
SCHEMBL27124690 0.93 PDE7A (0.36) RAD52PDE7APDE3APDE10AIKBKB
SCHEMBL30759613 0.88 PDE7A (0.33) PDE7APDE3APDE10AALDH1A1KDM4E
SCHEMBL30759546 0.88 PDE7A (0.34) PDE7APDE3APDE10AALDH1A1KDM4E
SCHEMBL27124747 0.88 PDE7A (0.34) PDE7APDE3APDE10AALDH1A1KDM4E
SCHEMBL27124676 0.88 PDE7A (0.33) PDE7APDE3APDE10AALDH1A1KDM4E
SCHEMBL30759598 0.84 RAD52 (0.38) RAD52PDE7APDE3APDE10AIKBKB
SCHEMBL27119523 0.84 RAD52 (0.38) RAD52PDE7APDE3APDE10AIKBKB
SCHEMBL30759622 0.81 PDE7A (0.40) RAD52PDE7APDE3APDE10AALDH1A1
SCHEMBL30759620 0.81 PDE7A (0.40) RAD52PDE7APDE3APDE10AALDH1A1

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-2024044778-A2 NOVEL MODULATORS OF FSHR AND USES THEREOF CELMATIX INC. (US) 2024-02-29 — — WO disclosed
WO-2024044778-A2 NOVEL MODULATORS OF FSHR AND USES THEREOF CELMATIX INC. (US) 2024-02-29 — — WO disclosed
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