SCHEMBL2373312

SCHEMBL2373312

CC(C)Oc1cc(N)ccc1Br

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.42
GAA P10253 3/20 0.42
TLR8 Q9NR97 1/20 0.39
MAPT P10636 5/20 0.38
NPSR1 Q6W5P4 1/20 0.38
HTT P42858 2/20 0.37
TSHR P16473 1/20 0.37
MAPK1 P28482 1/20 0.37
CSNK2A1 P68400 2/20 0.36
HTR2A P28223 1/20 0.36
HTR2C P28335 1/20 0.36
HTR2B P41595 1/20 0.36
MCHR1 Q99705 1/20 0.35
IRAK4 Q9NWZ3 2/20 0.34
KDM4E B2RXH2 2/20 0.34
HRH4 Q9H3N8 1/20 0.34
POLB P06746 3/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
LMNA P02545 1/20 0.33

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
SCHEMBL1272998 0.84 ALDH1A1 (0.42) ALDH1A1GAATLR8MAPTNPSR1
SCHEMBL7325807 0.81 ALDH1A1 (0.50) ALDH1A1GAATLR8MAPTHTT
SCHEMBL16899381 0.80 MBOAT4 (0.39) ALDH1A1GAAMAPTNPSR1HTT
Hydrochloric Acid SCHEMBL10607534 0.79 ALDH1A1 (0.53) ALDH1A1GAATLR8MAPTHTT
SCHEMBL7519140 0.79 ALDH1A1 (0.44) ALDH1A1GAATLR8MAPTHTT
SCHEMBL13963701 0.78 PDE10A (0.48) ALDH1A1GAATLR8MAPTHTT
SCHEMBL8145073 0.78 ALDH1A1 (0.48) ALDH1A1GAATLR8MAPTHTT
SCHEMBL7480756 0.78 ACHE (0.40) ALDH1A1MAPTNPSR1TSHRCSNK2A1
SCHEMBL109131 0.77 MAPT (0.55) ALDH1A1GAAMAPTNPSR1HTT
SCHEMBL2372500 0.76 CSNK2A1 (0.47) ALDH1A1GAATLR8MAPTHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-122070287-A IRAK 4-targeted degradation agent compound and application thereof 江苏先声药业有限公司 2026-05-19 CN disclosed
WO-2025077891-A1 DEGRADATION AGENT COMPOUND TARGETING IRAK4, AND USE THEREOF 江苏先声药业有限公司 2025-04-17 WO disclosed
WO-2011119693-A1 TRPV4 ANTAGONISTS GLAXOSMITHKLINE LLC (US) 2011-09-29 WO disclosed
WO-2011119704-A1 TRPV4 ANTAGONISTS GLAXOSMITHKLINE LLC (US) 2011-09-29 WO disclosed
WO-2011119704-A1 TRPV4 ANTAGONISTS GLAXOSMITHKLINE LLC (US) 2011-09-29 WO disclosed