SCHEMBL6801424

SCHEMBL6801424

CCC(=O)O[C@]1(C(C)=O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@@]21C

nearest known ligand 0.82

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AR P10275 4/20 0.82
LMNA P02545 6/20 0.81
CYP3A4 P08684 6/20 0.81
NR3C1 P04150 5/20 0.81
PGR P06401 5/20 0.81
SMN1; SMN2 Q16637 4/20 0.81
MAPT P10636 3/20 0.81
HIF1A Q16665 3/20 0.81
MEN1 O00255 2/20 0.81
ADORA3 P0DMS8 2/20 0.81
SLC6A3 Q01959 2/20 0.81
KMT2A Q03164 2/20 0.81
NR1I2 O75469 2/20 0.81
NPSR1 Q6W5P4 2/20 0.81
HPGD P15428 1/20 0.81
MLNR O43193 1/20 0.81
HTT P42858 1/20 0.81
PDE4D Q08499 1/20 0.81
PDE3A Q14432 1/20 0.81
SHBG P04278 4/20 0.64

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
SCHEMBL20101055 0.92 NR3C1 (0.88) ARLMNACYP3A4NR3C1PGR
SCHEMBL11511136 0.92 LMNA (0.78) ARLMNACYP3A4NR3C1PGR
SCHEMBL11229308 0.92 AR (0.89) ARLMNACYP3A4NR3C1PGR
SCHEMBL11020429 0.92 AR (0.89) ARLMNACYP3A4NR3C1PGR
SCHEMBL17519899 0.91 LMNA (0.96) ARLMNACYP3A4NR3C1PGR
SCHEMBL11510015 0.91 LMNA (0.77) ARLMNACYP3A4NR3C1PGR
SCHEMBL571389 0.91 LMNA (0.77) ARLMNACYP3A4NR3C1PGR
SCHEMBL11510625 0.91 LMNA (0.77) ARLMNACYP3A4NR3C1PGR
Clascoterone SCHEMBL25297448 0.90 AR (1.00) ARLMNACYP3A4NR3C1PGR
Clascoterone SCHEMBL24688164 0.90 AR (1.00) ARLMNACYP3A4NR3C1PGR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114126710-A Segmented intravaginal EVA ring containing progesterone B·马特尔 2022-03-01 CN disclosed
US-20140349969-A1 COMPOUNDS AND METHODS FOR TREATING PAIN AKRON MOLECULES AG (AT) 2014-11-27 US disclosed
EP-2674161-A1 FMO3 inhibitors for treating pain Akron Molecules GmbH (AT) 2013-12-18 EP disclosed
US-20130252924-A1 Compounds and Methods for Treating Pain AKRON MOLECULES GMBH (AT) 2013-09-26 US disclosed
US-20040250300-A1 Expression of proteins in milk PHARMING B.V. (NL) 2004-12-09 US disclosed
US-20020129387-A1 EXPRESSION OF PROTEINS IN MILK PHARMING INTELLECTUAL PROPERTY B.V. (NL) 2002-09-12 US disclosed
US-5750172-A Transgenic non human mammal milk PHARMING B.V. (NL) 1998-05-12 US disclosed
EP-0347431-B1 EXPRESSION OF PROTEINS IN MILK GENE PHARMING EUROP BV (NL) 1995-10-04 EP disclosed
US-4873316-A Isolation of exogenous recombinant proteins from the milk of transgenic mammals BIOGEN, INC. (US) 1989-10-10 US disclosed
WO-1988010118-A1 EXPRESSION OF PROTEINS IN MILK BIOGEN N.V. (AN) 1988-12-29 WO disclosed
EP-0036145-B1 AN ORALLY ADMINISTERED DRUG FORM COMPRISING A POLAR BIOACTIVE AGENT AND AN ADJUVANT INTERx RESEARCH CORPORATION (US) 1985-05-29 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 (2 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-20140349969-A1 COMPOUNDS AND METHODS FOR TREATING PAIN TRPV1, ACHE, OPRL1 AR 3036/4885LMNA 3003/4885CYP3A4 2764/4885
US-20130252924-A1 Compounds and Methods for Treating Pain TRPV1, ACHE, OPRL1 AR 3036/4885LMNA 3003/4885CYP3A4 2764/4885

“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.