SCHEMBL27361372

SCHEMBL27361372

C=CC(=O)Nc1cc(C)ccc1N1CCN(C)CC1

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
UCHL3 P15374 1/20 0.51
EGFR P00533 5/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
WDR5 P61964 2/20 0.48
GAA P10253 1/20 0.47
MAPKAPK2 P49137 2/20 0.47
KMT2A Q03164 3/20 0.46
MEN1 O00255 2/20 0.46
KIT P10721 1/20 0.46
PDGFRA P16234 1/20 0.46
KDR P35968 1/20 0.46
CTSC P53634 2/20 0.45
TGM2 P21980 1/20 0.44

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
SCHEMBL16095969 0.86 EGFR (0.58) UCHL3EGFRSMN1; SMN2WDR5GAA
SCHEMBL16095355 0.86 EGFR (0.51) UCHL3EGFRSMN1; SMN2WDR5GAA
SCHEMBL30935288 0.84 UCHL3 (0.48) UCHL3EGFRSMN1; SMN2WDR5GAA
SCHEMBL27361377 0.82 F13A1 (0.54) SMN1; SMN2KMT2AMEN1TGM2
SCHEMBL16096147 0.82 WDR5 (0.67) WDR5GAA
SCHEMBL8716846 0.79 WDR5 (0.48) SMN1; SMN2WDR5GAAKMT2AMEN1
SCHEMBL30935308 0.78 UCHL3 (0.43) UCHL3EGFRSMN1; SMN2WDR5GAA
SCHEMBL16099962 0.78 UCHL3 (0.43) UCHL3EGFRSMN1; SMN2WDR5GAA
SCHEMBL24726489 0.78 EGFR (0.54) UCHL3EGFRCTSC
SCHEMBL22895403 0.77 UCHL3 (0.52) UCHL3EGFRMAPKAPK2CTSC

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-2024048809-A1 HETEROARYL DERIVATIVE CONTAINING N, PHARMACEUTICAL COMPOSITION COMPRISING SAME, AND USE THEREOF 보로노이 주식회사 2024-03-07 WO disclosed