SCHEMBL25816467

SCHEMBL25816467

CC(=O)N(C)CCCCN(C)CCOCCOCCN(C)C(C)=O

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 4/20 0.35
BLM P54132 1/20 0.34
PMP22 Q01453 1/20 0.34
HSD17B10 Q99714 1/20 0.34
LSS P48449 1/20 0.32
LMNA P02545 1/20 0.32
MAOB P27338 2/20 0.31
ALDH1A1 P00352 2/20 0.31
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
BCHE P06276 1/20 0.31
ACHE P22303 1/20 0.31
KDM4E B2RXH2 1/20 0.31
CHRM1 P11229 1/20 0.31

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
SCHEMBL25816463 0.98 SLC6A4 (0.33) SLC6A4BLMPMP22HSD17B10MAOB
SCHEMBL25816466 0.96 CHRM2 (0.34) SLC6A4LSSMAOBBCHEACHE
SCHEMBL25816470 0.92 BLM (0.39) SLC6A4BLMPMP22HSD17B10LMNA
SCHEMBL25816458 0.90 CHRM1 (0.35) SLC6A4BLMPMP22HSD17B10LMNA
SCHEMBL11608467 0.86 BLM (0.43) BLMPMP22HSD17B10ALDH1A1KDM4E
SCHEMBL25836689 0.85 CHRM1 (0.41) ALDH1A1MEN1KMT2AKDM4ECHRM1
SCHEMBL24572131 0.79 TSHR (0.43) BLMPMP22HSD17B10ALDH1A1MEN1
SCHEMBL24572499 0.79 TSHR (0.43) BLMPMP22HSD17B10ALDH1A1MEN1
SCHEMBL25816462 0.79 CHRM1 (0.32) CHRM1
SCHEMBL15224095 0.79 HSD17B10 (0.38) BLMPMP22HSD17B10ALDH1A1KDM4E

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-2023125806-A1 CONJUGATE FOR PREVENTING AND TREATING VIRAL INFECTIONS AND USE THEREOF 苏州爱科百发生物医药技术有限公司 2023-07-06 WO disclosed