SCHEMBL26463265

SCHEMBL26463265

Cc1ccncc1-c1ccc2c(c1)OCC(=O)N2

nearest known ligand 0.64

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 2/20 0.64
CYP11B2 P19099 2/20 0.64
NSD2 O96028 13/20 0.53
PDE3B Q13370 1/20 0.50
PDE3A Q14432 1/20 0.50
DYRK1A Q13627 1/20 0.46
MAP4K1 Q92918 1/20 0.46
NSD3 Q9BZ95 1/20 0.46
MMP12 P39900 1/20 0.45

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
SCHEMBL30494449 1.00 CYP11B1 (0.64) CYP11B1CYP11B2NSD2PDE3BPDE3A
SCHEMBL30494187 0.90 NR3C2 (0.55) CYP11B1CYP11B2PDE3BPDE3AMMP12
SCHEMBL26463277 0.90 NR3C2 (0.55) CYP11B1CYP11B2PDE3BPDE3AMMP12
SCHEMBL26463637 0.88 CYP11B1 (0.49) CYP11B1CYP11B2NSD2PDE3BPDE3A
SCHEMBL30494352 0.88 CYP11B1 (0.49) CYP11B1CYP11B2NSD2PDE3BPDE3A
SCHEMBL30494337 0.81 GRIA1 (0.48) CYP11B1CYP11B2PDE3BPDE3A
SCHEMBL26463628 0.81 GRIA1 (0.48) CYP11B1CYP11B2PDE3BPDE3A
SCHEMBL16475232 0.79 CYP11B1 (0.51) CYP11B1CYP11B2NSD2PDE3BPDE3A
SCHEMBL1119431 0.78 CYP11B1 (1.00) CYP11B1CYP11B2NSD2PDE3BPDE3A
SCHEMBL30494335 0.78 CYP11B1 (0.45) CYP11B1CYP11B2PDE3BPDE3ADYRK1A

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
CN-118176181-A SARM1 modulators, their preparation and use 维泰瑞隆有限公司 2024-06-11 CN disclosed
WO-2023072026-A1 SARM1 MODULATORS, PREPARATIONS, AND USES THEREOF Sironax Ltd. (KY) 2023-05-04 WO disclosed