SCHEMBL24102401

SCHEMBL24102401

C#C[C@]1(OC(=O)CCCC(=O)O)CCC2C3CCC4=CC(=O)CCC4C3CC[C@@]21CC

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PGR P06401 8/20 0.63
▸ LMNA P02545 6/20 0.63
▸ AR P10275 6/20 0.63
▸ SLC6A4 P31645 5/20 0.63
▸ CYP3A4 P08684 5/20 0.63
▸ NR3C1 P04150 4/20 0.63
▸ ABCB11 O95342 4/20 0.63
▸ ESR1 P03372 4/20 0.63
▸ SHBG P04278 4/20 0.63
▸ MEN1 O00255 3/20 0.63
▸ KMT2A Q03164 3/20 0.63
▸ CYP2C19 P33261 3/20 0.63
▸ POLB P06746 1/20 0.63
▸ ADORA3 P0DMS8 2/20 0.62
▸ SLC6A2 P23975 2/20 0.62
▸ NR1I2 O75469 2/20 0.62
▸ AGTR1 P30556 1/20 0.62
▸ DRD3 P35462 1/20 0.62
▸ SLC6A3 Q01959 1/20 0.62
▸ PDE4D Q08499 1/20 0.62

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
SCHEMBL24103266 1.00 PGR (0.63) PGRLMNAARSLC6A4CYP3A4
SCHEMBL8853386 0.93 PGR (0.65) PGRLMNAARSLC6A4CYP3A4
SCHEMBL8853332 0.92 PGR (0.64) PGRLMNAARSLC6A4CYP3A4
SCHEMBL11694584 0.92 PGR (0.64) PGRLMNAARSLC6A4CYP3A4
SCHEMBL25863267 0.92 PGR (0.63) PGRLMNAARSLC6A4CYP3A4
SCHEMBL25863273 0.92 PGR (0.63) PGRLMNAARSLC6A4CYP3A4
SCHEMBL11694580 0.92 PGR (0.63) PGRLMNAARSLC6A4CYP3A4
SCHEMBL25863270 0.92 PGR (0.63) PGRLMNAARSLC6A4CYP3A4
SCHEMBL25863269 0.92 PGR (0.63) PGRLMNAARSLC6A4CYP3A4
SCHEMBL8853347 0.92 PGR (0.63) PGRLMNAARSLC6A4CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230227492-A1 MONOMERIC AND OLIGOMERIC COMPOUND EMBODIMENTS AS CONTRACEPTIVES AND THERAPIES AND METHODS OF MAKING AND USING THE SAME THE USA AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2023-07-20 — — US disclosed
US-20230227492-A1 MONOMERIC AND OLIGOMERIC COMPOUND EMBODIMENTS AS CONTRACEPTIVES AND THERAPIES AND METHODS OF MAKING AND USING THE SAME THE USA AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2023-07-20 — — US disclosed
WO-2021252761-A2 MONOMERIC AND OLIGOMERIC COMPOUND EMBODIMENTS AS CONTRACEPTIVES AND THERAPIES AND METHODS OF MAKING AND USING THE SAME THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2021-12-16 — — 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-20230227492-A1 MONOMERIC AND OLIGOMERIC COMPOUND EMBODIMENTS AS CONTRACEPTIVES AND THERAPIES AND METHODS OF MAKING AND USING THE SAME SHBG, CYP19A1, GNRHR PGR 16/4885LMNA 388/4885AR 7/4885

“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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