SCHEMBL27330598

SCHEMBL27330598

CC(C)C(=O)CN1CCOCCN(CC=O)CCN(CC(=O)O)CCOCCN(CC(=O)O)CC1

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 2/20 0.54
ALDH1A1 P00352 4/20 0.41
SMN1; SMN2 Q16637 2/20 0.40
KDM4E B2RXH2 3/20 0.39
ALOX15 P16050 1/20 0.38
TSHR P16473 1/20 0.38
GLA P06280 1/20 0.37
LMNA P02545 2/20 0.35
PLK1 P53350 1/20 0.34
USP2 O75604 1/20 0.34
MAPT P10636 1/20 0.33
MAPK1 P28482 1/20 0.33

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
SCHEMBL22599399 0.91 HSD17B10 (0.38) HSD17B10ALDH1A1SMN1; SMN2KDM4E
SCHEMBL27330609 0.90 HSD17B10 (0.67) HSD17B10ALDH1A1SMN1; SMN2KDM4EALOX15
SCHEMBL27303608 0.88 HSD17B10 (0.69) HSD17B10ALDH1A1SMN1; SMN2KDM4EALOX15
SCHEMBL27018306 0.88 HSD17B10 (0.69) HSD17B10ALDH1A1SMN1; SMN2KDM4EALOX15
SCHEMBL26272100 0.88 HSD17B10 (0.69) HSD17B10ALDH1A1SMN1; SMN2KDM4EALOX15
SCHEMBL29299565 0.84 HSD17B10 (0.59) HSD17B10ALDH1A1SMN1; SMN2KDM4EALOX15
SCHEMBL12158507 0.82 KDM4E (0.55) HSD17B10ALDH1A1SMN1; SMN2KDM4EALOX15
SCHEMBL26270951 0.81 HSD17B10 (0.54) HSD17B10ALDH1A1SMN1; SMN2KDM4EALOX15
SCHEMBL24220956 0.80 HSD17B10 (0.47) HSD17B10ALDH1A1SMN1; SMN2KDM4E
SCHEMBL21764427 0.80 HSD17B10 (0.47) HSD17B10ALDH1A1SMN1; SMN2KDM4E

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-2024129600-A1 GONADOTROPIN-RELEASING HORMONE RECEPTOR (GNRHR) TARGETED THERAPEUTICS AND USES THEREOF RADIONETICS ONCOLOGY, INC. (US) 2024-06-20 WO disclosed