SCHEMBL23929223

SCHEMBL23929223

O=[C]c1cc(CCc2ccccc2)n[nH]1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ KCNH2 Q12809 1/20 0.43
▸ BACE1 P56817 2/20 0.42
▸ DAO P14920 3/20 0.41
▸ ESR1 P03372 1/20 0.39
▸ ESR2 Q92731 1/20 0.39
▸ MAOB P27338 2/20 0.38
▸ PARP1 P09874 1/20 0.37
▸ AURKA O14965 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ TDP1 Q9NUW8 1/20 0.36
▸ MAOA P21397 1/20 0.36
▸ HCAR3 P49019 1/20 0.36
▸ NOS1 P29475 1/20 0.36
▸ HCAR2 Q8TDS4 1/20 0.36

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
SCHEMBL23929224 0.75 KCNH2 (0.44) KCNH2BACE1DAOESR1ESR2
SCHEMBL13495125 0.74 L3MBTL1 (0.47) KCNH2BACE1DAOESR1ESR2
SCHEMBL64650 0.74 BACE1 (0.49) KCNH2BACE1DAOESR1ESR2
SCHEMBL17672395 0.73 HCAR2 (0.60) KCNH2DAOHCAR3HCAR2
SCHEMBL27768180 0.72 RAB9A (0.52) KCNH2BACE1DAOESR1ESR2
SCHEMBL14719095 0.72 DAO (0.55) KCNH2BACE1DAOPARP1HCAR2
SCHEMBL15964734 0.71 HCAR3 (0.47) KCNH2BACE1DAOAURKALMNA
SCHEMBL28809834 0.70 AKR1B1 (0.50) KCNH2BACE1DAOMAOBPARP1
SCHEMBL24622014 0.70 KCNH2 (0.43) KCNH2BACE1DAOESR1ESR2
SCHEMBL6367872 0.70 TP53 (0.43) KCNH2BACE1DAOESR1ESR2

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
EP-4139275-A1 COMPOUNDS AND PHARMACEUTICAL USES THEREOF Syneurx International (Taiwan) Corp. (TW) 2023-03-01 — — EP disclosed
WO-2021213500-A1 COMPOUNDS AND PHARMACEUTICAL USES THEREOF SYNEURX INTERNATIONAL (TAIWAN) CORP. (CN) 2021-10-28 — — WO disclosed
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