SCHEMBL4876809

SCHEMBL4876809

C=C1C(=C)[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]2(C)[C@@H]1CC(C(=O)O)C(=O)O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 8/20 0.55
LMNA P02545 7/20 0.55
MAPT P10636 6/20 0.55
SMN1; SMN2 Q16637 5/20 0.55
TSHR P16473 5/20 0.55
SHBG P04278 5/20 0.55
MAPK1 P28482 4/20 0.55
ALDH1A1 P00352 4/20 0.55
SERPINA6 P08185 4/20 0.55
NR3C1 P04150 4/20 0.55
PGR P06401 4/20 0.55
AR P10275 4/20 0.55
CYP2C9 P11712 3/20 0.55
GPBAR1 Q8TDU6 3/20 0.55
SIGMAR1 Q99720 3/20 0.55
HIF1A Q16665 2/20 0.55
ABCB11 O95342 2/20 0.55
KDM4E B2RXH2 2/20 0.55
CYP2C19 P33261 2/20 0.55
NR1I2 O75469 2/20 0.55

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
SCHEMBL4907194 0.90 PSEN1 (0.47) CYP3A4LMNAMAPTSMN1; SMN2TSHR
SCHEMBL4885690 0.86 CYP3A4 (0.55) CYP3A4LMNAMAPTSMN1; SMN2TSHR
SCHEMBL7236930 0.86 CYP3A4 (0.55) CYP3A4LMNAMAPTSMN1; SMN2TSHR
SCHEMBL10957754 0.85 CYP3A4 (0.54) CYP3A4LMNAMAPTSMN1; SMN2TSHR
SCHEMBL7280550 0.83 CYP3A4 (0.52) CYP3A4LMNAMAPTSMN1; SMN2TSHR
Potassium Ion SCHEMBL10957761 0.83 CYP3A4 (0.53) CYP3A4LMNAMAPTSMN1; SMN2TSHR
SCHEMBL3275154 0.83 LMNA (0.53) CYP3A4LMNAMAPTSMN1; SMN2TSHR
SCHEMBL11684717 0.78 LMNA (0.68) CYP3A4LMNAMAPTSMN1; SMN2TSHR
SCHEMBL3356958 0.77 SHBG (0.54) CYP3A4LMNAMAPTSMN1; SMN2TSHR
SCHEMBL3744154 0.76 CYP17A1 (0.56) CYP3A4LMNAMAPTSMN1; SMN2TSHR

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-20080194812-A1 Process for the Preparation of 17-Hydroxy-6Beta, 7Beta; 15Beta, 16Beta-Bismethylene- 17Alpha-Pregn-4-Ene-3-One-21-Carboxylic Acid Y-Lactone and Key Intermediates for this Process RICHTER GEDEON VEGYESZETI GYAR RT. (HU) 2008-08-14 US claimed

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-20080194812-A1 Process for the Preparation of 17-Hydroxy-6Beta, 7Beta; 15Beta, 16Beta-Bismethylene- 17Alpha-Pregn-4-Ene-3-One-21-Carboxylic Acid Y-Lactone and Key Intermediates for this Process CYP17A1, HSD17B7, HSD17B11 CYP3A4 55/4885LMNA 1403/4885MAPT 4288/4885

“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.