SCHEMBL6853658

SCHEMBL6853658

C=C[C@@H]1Cc2cc(OC)ccc2[C@H]2CCC3(CC)[C@@H](O)CC[C@H]3[C@H]12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.46
HSD17B10 Q99714 2/20 0.46
ESR1 P03372 6/20 0.44
SMN1; SMN2 Q16637 2/20 0.38
MAPT P10636 2/20 0.38
RECQL P46063 2/20 0.38
HSD17B1 P14061 2/20 0.38
HRH3 Q9Y5N1 1/20 0.36
PGR P06401 2/20 0.36
SLC6A3 Q01959 2/20 0.36
CYP2C19 P33261 2/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
HIF1A Q16665 1/20 0.36
ABCC1 P33527 1/20 0.36
NR3C1 P04150 1/20 0.36
CNR1 P21554 1/20 0.36
SLC6A2 P23975 1/20 0.36
SLC6A4 P31645 1/20 0.36
ABCC4 O15439 1/20 0.36

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
SCHEMBL6853652 1.00 LMNA (0.46) LMNAHSD17B10ESR1SMN1; SMN2MAPT
SCHEMBL5973822 0.86 LMNA (0.49) LMNAHSD17B10ESR1SMN1; SMN2MAPT
SCHEMBL5973819 0.86 LMNA (0.49) LMNAHSD17B10ESR1SMN1; SMN2MAPT
SCHEMBL7885573 0.85 LMNA (0.61) LMNAHSD17B10ESR1SMN1; SMN2MAPT
SCHEMBL6851927 0.85 LMNA (0.48) LMNAHSD17B10ESR1SMN1; SMN2MAPT
SCHEMBL6468428 0.85 LMNA (0.61) LMNAHSD17B10ESR1SMN1; SMN2MAPT
SCHEMBL6851933 0.85 LMNA (0.48) LMNAHSD17B10ESR1SMN1; SMN2MAPT
SCHEMBL2356424 0.85 LMNA (0.61) LMNAHSD17B10ESR1SMN1; SMN2MAPT
SCHEMBL6465985 0.85 LMNA (0.61) LMNAHSD17B10ESR1SMN1; SMN2MAPT
SCHEMBL6851876 0.80 HSD17B1 (0.48) LMNAHSD17B10ESR1SMN1; SMN2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6780854-B2 MALE CONTRACEPTION AKZO NOBEL NV (NL) 2004-08-24 US disclosed
EP-1203011-B1 ORALLY ACTIVE ANDROGENS AKZO NOBEL NV (NL) 2004-01-02 EP disclosed
US-6541465-B2 Delta 14 derivatives of 19- nortestosterone, useful for the preparation of a medicine for treating androgen insufficiency AKZO NOBEL N.V. (NL) 2003-04-01 US disclosed
EP-1203011-A1 ORALLY ACTIVE ANDROGENS Akzo Nobel N.V. (NL) 2002-05-08 EP disclosed
US-20020022609-A1 Orally active androgens LOOZEN HUBERT JAN JOZEF (NL) 2002-02-21 US disclosed
WO-2001005806-A1 ORALLY ACTIVE ANDROGENS AKZO NOBEL N.V. (NL) 2001-01-25 WO 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-20020022609-A1 Orally active androgens NR5A1, AR, CYP17A1 LMNA 2728/4885HSD17B10 41/4885ESR1 109/4885

“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.