SCHEMBL31482152

SCHEMBL31482152

O=C(c1cnc(Br)s1)N1CCC(N2CCCC(OCC3CC3)C2)CC1

nearest known ligand 0.60

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ ADRA1A P35348 10/20 0.60
▸ ADRA2C P18825 3/20 0.48
▸ L3MBTL3 Q96JM7 7/20 0.43
▸ L3MBTL1 Q9Y468 7/20 0.43
▸ L3MBTL4 Q8NA19 1/20 0.38

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
SCHEMBL31482196 0.97 ADRA1A (0.57) ADRA1AADRA2CL3MBTL3L3MBTL1L3MBTL4
SCHEMBL31482146 0.91 ADRA2C (0.51) ADRA1AADRA2CL3MBTL3L3MBTL1L3MBTL4
SCHEMBL31482182 0.84 ADRA1A (0.49) ADRA1AADRA2CL3MBTL3L3MBTL1L3MBTL4
SCHEMBL31482120 0.83 L3MBTL3 (0.44) ADRA1AL3MBTL3L3MBTL1L3MBTL4
SCHEMBL31482130 0.80 ADRA1A (0.56) ADRA1AL3MBTL3L3MBTL1L3MBTL4
Hydrochloric Acid SCHEMBL31482115 0.79 ADRA1A (0.55) ADRA1AL3MBTL3L3MBTL1L3MBTL4
SCHEMBL31482149 0.76 ADRA1A (0.46) ADRA1AADRA2CL3MBTL3L3MBTL1
SCHEMBL31482093 0.76 NPC1 (0.47) L3MBTL3L3MBTL1
SCHEMBL28842787 0.75 ADRA1A (0.55) ADRA1AADRA2CL3MBTL3L3MBTL1L3MBTL4
SCHEMBL16854294 0.75 ADRA1A (1.00) ADRA1AADRA2CL3MBTL3L3MBTL1

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-2025068514-A1 SUBSTITUTED HETEROCYCLIC CARBOXAMINDES AND USE THEREOF BAYER AKTIENGESELLSCHAFT (DE) 2025-04-03 — — WO disclosed
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