SCHEMBL1592817

SCHEMBL1592817

CCCC1[C@@H]2CCC3=CC(=O)C=C[C@]3(C)[C@H]2CC[C@]1(C)O

nearest known ligand 0.65

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.64
MAPT P10636 2/20 0.64
CYP19A1 P11511 12/20 0.57
CYP3A4 P08684 1/20 0.57
HSD17B10 Q99714 3/20 0.48
MEN1 O00255 1/20 0.48
ALDH1A1 P00352 1/20 0.48
NR3C1 P04150 1/20 0.48
PGR P06401 1/20 0.48
KMT2A Q03164 1/20 0.48
HIF1A Q16665 1/20 0.48
SLC29A1 Q99808 1/20 0.48
TDP1 Q9NUW8 1/20 0.48

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
SCHEMBL238494 0.88 LMNA (0.60) LMNAMAPTCYP19A1CYP3A4HSD17B10
SCHEMBL238493 0.88 LMNA (0.60) LMNAMAPTCYP19A1CYP3A4HSD17B10
SCHEMBL10960204 0.79 LMNA (0.74) LMNAMAPTCYP19A1CYP3A4HSD17B10
SCHEMBL10941399 0.79 LMNA (0.74) LMNAMAPTCYP19A1CYP3A4HSD17B10
Methandrostenolone SCHEMBL16755284 0.78 LMNA (1.00) LMNAMAPTCYP19A1CYP3A4HSD17B10
Methandrostenolone SCHEMBL8408550 0.78 LMNA (1.00) LMNAMAPTCYP19A1CYP3A4HSD17B10
SCHEMBL5270893 0.78 LMNA (0.81) LMNAMAPTCYP19A1CYP3A4HSD17B10
Methandrostenolone SCHEMBL28423591 0.78 LMNA (1.00) LMNAMAPTCYP19A1CYP3A4HSD17B10
Methandrostenolone SCHEMBL21177905 0.78 LMNA (1.00) LMNAMAPTCYP19A1CYP3A4HSD17B10
SCHEMBL10861103 0.78 LMNA (0.81) LMNAMAPTCYP19A1CYP3A4HSD17B10

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
US-8163805-B2 Small molecule antagonists of Bcl-2 family proteins THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2012-04-24 US disclosed
US-20110135710-A1 Methods and Compositions for the Inhibition of Gene Expression PRONAI THERAPEUTICS, INC. (US) 2011-06-09 US disclosed
US-7932382-B2 Amide substituted heterocylic compound; anticarcinogen; inducing apoptotic cell death, sensitizing cells to inducers of apoptosis THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2011-04-26 US disclosed
US-20110092452-A1 COMPOSITIONS AND METHODS FOR DIAGNOSING AND TREATING PANCREATIC CANCER THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2011-04-21 US disclosed
US-20090324587-A1 Cancer Therapies and Pharmaceutical Compositions Used Therein PRONAI THERAPEUTICS, INC. 2009-12-31 US 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-20090324587-A1 Cancer Therapies and Pharmaceutical Compositions Used Therein RNASE1, TP53, RNMT LMNA 3330/4885MAPT 3259/4885CYP19A1 2429/4885

“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.