SCHEMBL31630516

SCHEMBL31630516

Cc1nc(B2OC(C)(C)C(C)(C)O2)sc1C

nearest known ligand 0.35

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
NOS1 P29475 1/20 0.35

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
SCHEMBL950909 0.68
SCHEMBL28736684 0.67 SMN1; SMN2 (0.38) NOS1
SCHEMBL25199762 0.67 NOS1 (0.38) NOS1
SCHEMBL15112382 0.66 ALDH1A1 (0.41)
SCHEMBL30868020 0.64
SCHEMBL16267919 0.63
SCHEMBL17730821 0.63 COMT (0.33)
SCHEMBL16767804 0.63 LPL (0.33)
SCHEMBL21229284 0.63 LPL (0.31)
SCHEMBL15532387 0.63 LPL (0.31)

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-2025124429-A1 AROMATIC AMINE COMPOUND, AND PHARMACEUTICAL COMPOSITION AND USE THEREOF 北京康辰药业股份有限公司 2025-06-19 WO disclosed