SCHEMBL11264397

SCHEMBL11264397

C[C@]12CCC(=O)C=C1CC[C@@H]1[C@H]2CC[C@@]2(C)[C@H]1CCC2(O)C(N)=O

nearest known ligand 0.81

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 9/20 0.81
▸ SHBG P04278 8/20 0.81
▸ SERPINA6 P08185 7/20 0.81
▸ SMN1; SMN2 Q16637 5/20 0.81
▸ NR3C1 P04150 5/20 0.81
▸ BLM P54132 4/20 0.81
▸ CYP2C19 P33261 3/20 0.81
▸ MEN1 O00255 2/20 0.81
▸ KMT2A Q03164 2/20 0.81
▸ MAPT P10636 2/20 0.81
▸ ADORA3 P0DMS8 1/20 0.81
▸ MAPK3 P27361 1/20 0.81
▸ SLC6A3 Q01959 1/20 0.81
▸ HSD17B10 Q99714 7/20 0.76
▸ TSHR P16473 5/20 0.76
▸ HIF1A Q16665 3/20 0.76
▸ PMP22 Q01453 3/20 0.76
▸ CYP3A4 P08684 3/20 0.76
▸ PGR P06401 4/20 0.72
▸ ALDH1A1 P00352 3/20 0.72

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
SCHEMBL11264395 1.00 LMNA (0.81) LMNASHBGSERPINA6SMN1; SMN2NR3C1
SCHEMBL3362526 0.92 LMNA (0.83) LMNASHBGSERPINA6SMN1; SMN2NR3C1
SCHEMBL4443903 0.92 LMNA (0.83) LMNASHBGSERPINA6SMN1; SMN2NR3C1
Hydroxyprogesterone SCHEMBL13558389 0.89 LMNA (1.00) LMNASHBGSERPINA6SMN1; SMN2NR3C1
Hydroxyprogesterone SCHEMBL18261234 0.89 LMNA (1.00) LMNASHBGSERPINA6SMN1; SMN2NR3C1
Hydroxyprogesterone SCHEMBL23456341 0.89 LMNA (1.00) LMNASHBGSERPINA6SMN1; SMN2NR3C1
Hydroxyprogesterone SCHEMBL14546356 0.89 LMNA (1.00) LMNASHBGSERPINA6SMN1; SMN2NR3C1
Hydroxyprogesterone SCHEMBL3931615 0.89 LMNA (1.00) LMNASHBGSERPINA6SMN1; SMN2NR3C1
Hydroxyprogesterone SCHEMBL24287585 0.89 LMNA (1.00) LMNASHBGSERPINA6SMN1; SMN2NR3C1
Hydroxyprogesterone SCHEMBL265609 0.89 LMNA (1.00) LMNASHBGSERPINA6SMN1; SMN2NR3C1

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
US-4348327-A Process for the preparation of 17α-hydroxy- and 17aα-hydroxy-D-homoetiocarboxylic acids SCHERING AKTIENGESELLSCHAFT (DE) 1982-09-07 — — US disclosed
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