SCHEMBL4660380

SCHEMBL4660380

CCC1C[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3CC[C@]2(C)[C@H]1C(=O)CO

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PGR P06401 2/20 1.00
▸ SERPINA6 P08185 2/20 0.56
▸ SHBG P04278 2/20 0.56
▸ ALDH1A1 P00352 2/20 0.56
▸ SLC22A1 O15245 1/20 0.56
▸ THRB P10828 1/20 0.56
▸ CYP19A1 P11511 2/20 0.51
▸ LMNA P02545 5/20 0.51
▸ MAPT P10636 2/20 0.51
▸ CYP3A4 P08684 4/20 0.47
▸ MEN1 O00255 2/20 0.47
▸ KMT2A Q03164 2/20 0.47
▸ SLC6A4 P31645 2/20 0.47
▸ CYP2C19 P33261 2/20 0.47
▸ ABCB11 O95342 2/20 0.47
▸ NR3C1 P04150 1/20 0.47
▸ POLB P06746 1/20 0.47
▸ ESR1 P03372 1/20 0.47
▸ AR P10275 1/20 0.47
▸ TSHR P16473 1/20 0.47

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
SCHEMBL3273165 1.00 PGR (1.00) PGRSERPINA6SHBGALDH1A1SLC22A1
SCHEMBL21010519 1.00 PGR (1.00) PGRSERPINA6SHBGALDH1A1SLC22A1
SCHEMBL17078378 1.00 PGR (1.00) PGRSERPINA6SHBGALDH1A1SLC22A1
SCHEMBL14870642 1.00 PGR (1.00) PGRSERPINA6SHBGALDH1A1SLC22A1
SCHEMBL29778360 0.91 PGR (0.84) PGRSERPINA6SHBGALDH1A1SLC22A1
Oxendolone SCHEMBL10380170 0.85 PGR (0.74) PGRSERPINA6SHBGALDH1A1SLC22A1
Oxendolone SCHEMBL233297 0.85 PGR (0.74) PGRSERPINA6SHBGALDH1A1SLC22A1
Oxendolone SCHEMBL1650323 0.85 PGR (0.74) PGRSERPINA6SHBGALDH1A1SLC22A1
Oxendolone SCHEMBL12826307 0.85 PGR (0.74) PGRSERPINA6SHBGALDH1A1SLC22A1
SCHEMBL10889253 0.83 PGR (0.72) PGRSERPINA6SHBGALDH1A1SLC22A1

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1020191-B1 Medicaments for hyperlipidemic and hyperglycemic conditions COUNCIL SCIENT IND RES (IN) 2008-12-24 — — EP disclosed
US-6875758-B2 Method of treating hyperlipidemic and hyperglycemic conditions in mammals using pregnadienols and pregnadienones COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2005-04-05 — — US disclosed
US-20030216363-A1 Method of treating hyperlipidemic and hyperglycemic conditions in mammals using pregnadienols and pregnadienones COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH 2003-11-20 — — US disclosed
US-6579862-B1 3B-hydroxy-pregna-5,16-dien-20-one COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2003-06-17 — — US disclosed
EP-1020191-A1 Medicaments for hypolipidemic and hypoglycemic conditions Council of Scientific and Industrial Research (IN) 2000-07-19 — — EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030216363-A1 Method of treating hyperlipidemic and hyperglycemic conditions in mammals using pregnadienols and pregnadienones CYP27A1, CYP46A1, HSD17B7 PGR 764/4885SERPINA6 214/4885SHBG 41/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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