SCHEMBL25432124

SCHEMBL25432124

O=c1cc[nH]c2nc(-c3cccnc3Oc3ccc(S(F)(F)(F)(F)F)cc3)ccc12

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ ELANE P08246 1/20 0.40
▸ PDE10A Q9Y233 9/20 0.37
▸ ADORA2A P29274 1/20 0.36
▸ ADORA1 P30542 1/20 0.36
▸ AURKB Q96GD4 3/20 0.35
▸ AURKA O14965 2/20 0.34
▸ TPX2 Q9ULW0 2/20 0.34
▸ TEK Q02763 1/20 0.34

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
SCHEMBL25430011 0.87 TTBK1 (0.41) ELANEPDE10AADORA2AADORA1AURKB
SCHEMBL25430881 0.80 PDE10A (0.42) ELANEPDE10A
SCHEMBL25430936 0.73 GSK3B (0.35) ELANEPDE10AAURKBAURKATPX2
SCHEMBL25430366 0.72 TTBK1 (0.42) ADORA2AADORA1
SCHEMBL25431453 0.67 FEN1 (0.40) PDE10A
SCHEMBL25380655 0.67 FEN1 (0.46) PDE10A
SCHEMBL20406094 0.67 PDE10A (0.45) PDE10A
SCHEMBL30482538 0.67 PDE10A (0.45) PDE10A
SCHEMBL25339739 0.67 DRD1 (0.43) PDE10A
SCHEMBL25341778 0.65 PDE10A (0.47) PDE10A

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-2023146511-A1 COMPOUNDS AND METHODS OF USE THEREOF VIVACE THERAPEUTICS, INC. (US) 2023-08-03 — — WO disclosed
WO-2023146511-A1 COMPOUNDS AND METHODS OF USE THEREOF VIVACE THERAPEUTICS, INC. (US) 2023-08-03 — — WO disclosed
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