SCHEMBL25816470

SCHEMBL25816470

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

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
BLM P54132 1/20 0.39
PMP22 Q01453 1/20 0.39
HSD17B10 Q99714 1/20 0.39
LMNA P02545 1/20 0.35
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
CHRM1 P11229 1/20 0.34
ALDH1A1 P00352 3/20 0.34
KDM4E B2RXH2 2/20 0.33
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA9 Q16790 1/20 0.33
SLC6A4 P31645 2/20 0.32
DRD2 P14416 1/20 0.32
TSHR P16473 1/20 0.31
PDK2 Q15119 1/20 0.31
MTNR1A P48039 1/20 0.30
MTNR1B P49286 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
SCHEMBL25816458 0.98 CHRM1 (0.35) BLMPMP22HSD17B10LMNAMEN1
SCHEMBL11608467 0.93 BLM (0.43) BLMPMP22HSD17B10CHRM1ALDH1A1
SCHEMBL25816467 0.92 SLC6A4 (0.35) BLMPMP22HSD17B10LMNAMEN1
SCHEMBL25836689 0.92 CHRM1 (0.41) MEN1KMT2ACHRM1ALDH1A1KDM4E
SCHEMBL25816463 0.90 SLC6A4 (0.33) BLMPMP22HSD17B10MEN1KMT2A
SCHEMBL25816466 0.88 CHRM2 (0.34) CHRM1SLC6A4
SCHEMBL25816462 0.85 CHRM1 (0.32) CHRM1
SCHEMBL15224095 0.85 HSD17B10 (0.38) BLMPMP22HSD17B10CHRM1ALDH1A1
SCHEMBL5826288 0.85 BLM (0.38) BLMPMP22HSD17B10CHRM1ALDH1A1
SCHEMBL15224092 0.85 HSD17B10 (0.38) BLMPMP22HSD17B10CHRM1ALDH1A1

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