SCHEMBL10380864

SCHEMBL10380864

CCC[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3CC[C@]2(C)[C@H]1O

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PGR P06401 3/20 0.66
▸ SHBG P04278 3/20 0.64
▸ ALDH1A1 P00352 3/20 0.64
▸ SERPINA6 P08185 2/20 0.64
▸ SLC22A1 O15245 1/20 0.64
▸ THRB P10828 1/20 0.64
▸ CYP19A1 P11511 2/20 0.55
▸ LMNA P02545 5/20 0.54
▸ MAPT P10636 1/20 0.54
▸ CYP3A4 P08684 4/20 0.50
▸ SLC6A4 P31645 3/20 0.50
▸ ABCB11 O95342 3/20 0.50
▸ MEN1 O00255 2/20 0.50
▸ KMT2A Q03164 2/20 0.50
▸ CYP2C19 P33261 2/20 0.50
▸ NR3C1 P04150 2/20 0.50
▸ ESR1 P03372 2/20 0.50
▸ HIF1A Q16665 2/20 0.50
▸ TSHR P16473 1/20 0.50
▸ POLB P06746 1/20 0.50

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
Oxendolone SCHEMBL10380170 0.91 PGR (0.74) PGRSHBGALDH1A1SERPINA6SLC22A1
Oxendolone SCHEMBL12826307 0.91 PGR (0.74) PGRSHBGALDH1A1SERPINA6SLC22A1
Oxendolone SCHEMBL1650323 0.91 PGR (0.74) PGRSHBGALDH1A1SERPINA6SLC22A1
Oxendolone SCHEMBL233297 0.91 PGR (0.74) PGRSHBGALDH1A1SERPINA6SLC22A1
SCHEMBL10626927 0.84 ALDH1A1 (0.69) PGRSHBGALDH1A1SERPINA6SLC22A1
SCHEMBL10624478 0.84 ALDH1A1 (0.72) PGRSHBGALDH1A1SERPINA6SLC22A1
SCHEMBL17209910 0.84 SHBG (0.72) PGRSHBGALDH1A1SERPINA6SLC22A1
SCHEMBL21010519 0.79 PGR (1.00) PGRSHBGALDH1A1SERPINA6SLC22A1
SCHEMBL14870642 0.79 PGR (1.00) PGRSHBGALDH1A1SERPINA6SLC22A1
SCHEMBL17078378 0.79 PGR (1.00) PGRSHBGALDH1A1SERPINA6SLC22A1

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-1990005528-A2 ANTI-THROMBOTIC STEROIDS CHILDREN'S MEDICAL CENTER CORPORATION (US) 1990-05-31 — — WO disclosed
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