SCHEMBL27346587

SCHEMBL27346587

Cc1nc(C(F)(F)F)ccc1SN1CC2CN(C(=O)C34CCOC(C)(C3)C4)CC2C1

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ PDE2A O00408 2/20 0.32
▸ HCRTR1 O43613 1/20 0.30
▸ HCRTR2 O43614 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
SCHEMBL27346611 0.91 PDE2A (0.33) PDE2AHCRTR1HCRTR2
SCHEMBL30719552 0.83 TRPV4 (0.39) PDE2A
SCHEMBL30719563 0.83 TRPV4 (0.39) PDE2A
SCHEMBL27346590 0.83 TRPV4 (0.39) PDE2A
SCHEMBL27346597 0.80 KCNH2 (0.30) —
SCHEMBL27346552 0.75 NR1H2 (0.38) —
SCHEMBL26065201 0.75 KMT2A (0.38) —
SCHEMBL27346630 0.74 — —
SCHEMBL30719527 0.73 TRPV4 (0.40) PDE2A
SCHEMBL27346613 0.73 TRPV4 (0.40) PDE2A

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024015503-A1 EMOPAMIL-BINDING PROTEIN INHIBITORS AND USES THEREOF BIOGEN MA INC. (US) 2024-01-18 — — WO disclosed
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