SCHEMBL27119238

SCHEMBL27119238

COc1cc2c(cc1-c1cncc(C#N)c1)-c1c(c(C(=O)N(C)C(C)(C)C)nn1-c1ccsc1)C2

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ PDE7A Q13946 1/20 0.35
▸ PDE3A Q14432 1/20 0.35
▸ PDE10A Q9Y233 1/20 0.35
▸ CA12 O43570 1/20 0.33
▸ CA2 P00918 1/20 0.33
▸ CA9 Q16790 1/20 0.33
▸ CYP11B1 P15538 2/20 0.32
▸ CYP11B2 P19099 2/20 0.32
▸ GPR119 Q8TDV5 1/20 0.32
▸ BRD4 O60885 1/20 0.32
▸ CREBBP Q92793 1/20 0.32
▸ CYP3A4 P08684 1/20 0.30
▸ CYP19A1 P11511 1/20 0.30
▸ CHEK1 O14757 1/20 0.30
▸ ABL1 P00519 1/20 0.30
▸ CTPS1 P17812 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
SCHEMBL30759543 1.00 PDE7A (0.35) PDE7APDE3APDE10ACA12CA2
SCHEMBL27119255 0.88 PDE7A (0.35) PDE7APDE3APDE10ACA12CA2
SCHEMBL30759604 0.88 PDE7A (0.35) PDE7APDE3APDE10ACA12CA2
SCHEMBL27118975 0.88 PDE7A (0.35) PDE7APDE3APDE10ACA12CA2
SCHEMBL30759484 0.88 PDE7A (0.35) PDE7APDE3APDE10ACA12CA2
SCHEMBL27119215 0.84 PDE7A (0.38) PDE7APDE3APDE10ACA12CA2
SCHEMBL27119230 0.83 PDE7A (0.36) PDE7APDE3APDE10ACA12CA2
SCHEMBL30759597 0.82 PDE7A (0.36) PDE7APDE3APDE10ACYP11B1CYP11B2
SCHEMBL27119775 0.82 PDE7A (0.36) PDE7APDE3APDE10ACYP11B1CYP11B2
SCHEMBL30759585 0.81 GRM5 (0.33) CA12CA2CA9CYP11B1CYP11B2

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-4577206-A2 NOVEL MODULATORS OF FSHR AND USES THEREOF Celmatix Inc. (US) 2025-07-02 — — EP disclosed
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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