SCHEMBL24869052

SCHEMBL24869052

CNCCNc1cc(F)ccc1C(C)C

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ RECQL P46063 1/20 0.38
▸ SLC6A2 P23975 1/20 0.38
▸ TAAR1 Q96RJ0 2/20 0.38
▸ MPO P05164 2/20 0.35
▸ SLC6A4 P31645 3/20 0.32
▸ GCGR P47871 1/20 0.31
▸ FERMT2 Q96AC1 1/20 0.31
▸ APP P05067 1/20 0.31
▸ L3MBTL1 Q9Y468 1/20 0.31
▸ HTR2A P28223 2/20 0.31
▸ HRH1 P35367 1/20 0.31
▸ TLR9 Q9NR96 1/20 0.31
▸ TLR8 Q9NR97 1/20 0.31
▸ TLR7 Q9NYK1 1/20 0.31
▸ KCNH2 Q12809 1/20 0.30

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
SCHEMBL24869045 0.83 RECQL (0.41) RECQLMPOSLC6A4
SCHEMBL24869051 0.81 FLT3 (0.42) RECQLTAAR1
SCHEMBL24869039 0.78 RECQL (0.44) RECQLSLC6A2SLC6A4L3MBTL1HTR2A
SCHEMBL24869044 0.77 RECQL (0.38) RECQLMPOSLC6A4
SCHEMBL24869074 0.77 RECQL (0.38) RECQL
SCHEMBL12859014 0.74 RECQL (0.43) RECQLL3MBTL1KCNH2
SCHEMBL24869050 0.73 RECQL (0.46) RECQLSLC6A2
SCHEMBL14566075 0.71 SHMT2 (0.40) SLC6A2TAAR1MPOFERMT2
SCHEMBL2737221 0.71 L3MBTL1 (0.59) RECQLL3MBTL1
SCHEMBL24869058 0.68 RECQL (0.52) RECQLL3MBTL1

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-2023279986-A1 SIX-MEMBERED ARYL OR HETEROARYL AMIDES, AND COMPOSITION AND USE THEREOF 贝达药业股份有限公司 2023-01-12 — — WO disclosed
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