SCHEMBL24358693

SCHEMBL24358693

CC12CCC(=O)C=C1CCC1C2CCC2(C)C1CC[C@]2(C=O)C(=O)CCl

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SHBG P04278 8/20 0.62
LMNA P02545 8/20 0.62
HSD17B10 Q99714 7/20 0.62
SERPINA6 P08185 7/20 0.62
SMN1; SMN2 Q16637 5/20 0.62
TSHR P16473 5/20 0.62
BLM P54132 4/20 0.62
CYP2C19 P33261 3/20 0.62
PMP22 Q01453 3/20 0.62
CYP3A4 P08684 3/20 0.62
HIF1A Q16665 2/20 0.62
NR3C1 P04150 5/20 0.61
PGR P06401 4/20 0.61
ALDH1A1 P00352 3/20 0.61
ADRA1A P35348 1/20 0.61
HTR2B P41595 1/20 0.61
MEN1 O00255 2/20 0.60
KMT2A Q03164 2/20 0.60
MAPT P10636 2/20 0.60
ADORA3 P0DMS8 1/20 0.60

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
SCHEMBL10603296 0.87 SHBG (0.71) SHBGLMNAHSD17B10SERPINA6SMN1; SMN2
SCHEMBL10413142 0.85 AR (0.65) SHBGLMNAHSD17B10SERPINA6SMN1; SMN2
SCHEMBL3129400 0.84 HSD17B10 (0.82) SHBGLMNAHSD17B10SERPINA6SMN1; SMN2
SCHEMBL24358664 0.84 HSD17B10 (0.82) SHBGLMNAHSD17B10SERPINA6SMN1; SMN2
SCHEMBL11581843 0.80 AR (0.69) SHBGLMNAHSD17B10SERPINA6SMN1; SMN2
SCHEMBL13768056 0.79 SHBG (0.74) SHBGLMNAHSD17B10SERPINA6SMN1; SMN2
SCHEMBL22151956 0.79 SHBG (0.70) SHBGLMNAHSD17B10SERPINA6SMN1; SMN2
SCHEMBL10584769 0.78 SHBG (0.66) SHBGLMNAHSD17B10SERPINA6SMN1; SMN2
SCHEMBL4316119 0.77 SHBG (0.77) SHBGLMNAHSD17B10SERPINA6SMN1; SMN2
SCHEMBL24358662 0.77 HSD17B10 (0.84) SHBGLMNAHSD17B10SERPINA6SMN1; SMN2

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-2022084752-A1 PROCESS FOR THE PRODUCTION OF 21-(ACETYLOXY)-17-(PROPIONYLOXY)-PREGN-4-ENE-3,20-DIONE INDUSTRIALE CHIMICA S.R.L. (IT) 2022-04-28 WO disclosed