SCHEMBL30453025

SCHEMBL30453025

Cc1ccccc1COc1cc(-c2ccc(C(=O)N3CCC(N4CCCC4)CC3)cc2)cnc1N

nearest known ligand 0.56

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MET P08581 10/20 0.56
MERTK Q12866 6/20 0.54
AXL P30530 5/20 0.54
AVPR2 P30518 1/20 0.53
AVPR1A P37288 1/20 0.53
ATR Q13535 1/20 0.49
MAP4K4 O95819 1/20 0.46
L3MBTL3 Q96JM7 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46

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
SCHEMBL488733 1.00 MET (0.56) METMERTKAXLAVPR2AVPR1A
SCHEMBL10217527 0.92 MET (0.57) METMERTKAXLAVPR2AVPR1A
SCHEMBL10379635 0.91 MET (0.57) METATRMAP4K4
SCHEMBL10218036 0.90 MET (0.55) METMERTKAXLAVPR2AVPR1A
SCHEMBL10217770 0.90 MET (0.59) METMERTKAXLAVPR2AVPR1A
SCHEMBL488391 0.90 MET (0.68) METMERTKAXLAVPR2AVPR1A
SCHEMBL30453080 0.90 MET (0.68) METMERTKAXLAVPR2AVPR1A
SCHEMBL10217423 0.89 MET (0.54) METMERTKAXLAVPR2AVPR1A
SCHEMBL10217914 0.88 MET (0.55) METMERTKAXLAVPR2AVPR1A
SCHEMBL488613 0.88 MET (0.66) METMERTKAXLAVPR2AVPR1A

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
CN-113181362-B Medicament for preventing and/or treating amyotrophic lateral sclerosis 国立大学法人京都大学 2023-06-13 CN disclosed