SCHEMBL31370973

SCHEMBL31370973

OCC(F)(F)Oc1ccc(Br)nc1

nearest known ligand 0.40

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ CHRNB2 P17787 2/20 0.35
▸ CHRNA4 P43681 2/20 0.35
▸ MCHR1 Q99705 1/20 0.32
▸ DGAT1 O75907 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
SCHEMBL31362938 0.80 — —
SCHEMBL29499452 0.80 SLC7A5 (0.41) CHRNB2CHRNA4
SCHEMBL28694365 0.80 CHRNB2 (0.36) CHRNB2CHRNA4MCHR1DGAT1
SCHEMBL1472705 0.80 SLC7A5 (0.41) CHRNB2CHRNA4
SCHEMBL10329129 0.77 CHRNB2 (0.35) CHRNB2CHRNA4
SCHEMBL17442053 0.76 POLB (0.35) —
SCHEMBL31371172 0.76 ALDH1A1 (0.32) DGAT1
SCHEMBL31371069 0.76 SCN9A (0.30) —
SCHEMBL15918726 0.74 CHRNB2 (0.42) CHRNB2CHRNA4MCHR1DGAT1
SCHEMBL17099993 0.73 ALDH1A1 (0.41) CHRNB2CHRNA4

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-2025038782-A1 ADENOSINE LIGANDS FOR THE TREATMENT OF NEUROLOGICAL DISORDERS OR CHRONIC HEART FAILURE LUCY THERAPEUTICS, INC. (US) 2025-02-20 — — WO disclosed
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