SCHEMBL25863602

SCHEMBL25863602

CCCCCCCCCCCCOC(=O)O[C@H]1CCC2C3C(C4CCC(=O)C=C4C[C@H]3C)[C@@H](C)C[C@@]21C

nearest known ligand 0.78

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ AR P10275 12/20 0.78
▸ LMNA P02545 3/20 0.47
▸ MAPT P10636 3/20 0.47
▸ PGR P06401 7/20 0.36
▸ NR3C1 P04150 5/20 0.35
▸ SHBG P04278 2/20 0.33
▸ NR3C2 P08235 2/20 0.33
▸ SLC22A1 O15245 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ SERPINA6 P08185 1/20 0.33
▸ THRB P10828 1/20 0.33
▸ CYP3A4 P08684 2/20 0.33
▸ NR1I2 O75469 1/20 0.33
▸ CYP17A1 P05093 1/20 0.33
▸ CYP2C9 P11712 1/20 0.33
▸ TSHR P16473 1/20 0.33
▸ CYP2C19 P33261 1/20 0.33
▸ OPRK1 P41145 1/20 0.33

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
SCHEMBL3452488 1.00 AR (0.78) ARLMNAMAPTPGRNR3C1
SCHEMBL3452309 1.00 AR (0.78) ARLMNAMAPTPGRNR3C1
SCHEMBL3452180 1.00 AR (0.78) ARLMNAMAPTPGRNR3C1
SCHEMBL5030906 1.00 AR (0.78) ARLMNAMAPTPGRNR3C1
SCHEMBL25863600 0.99 AR (0.77) ARLMNAMAPTPGRNR3C1
SCHEMBL4232069 0.93 AR (0.67) ARLMNAMAPTPGRNR3C1
SCHEMBL4215627 0.93 AR (0.67) ARLMNAMAPTPGRNR3C1
SCHEMBL4215614 0.93 AR (0.67) ARLMNAMAPTPGRNR3C1
SCHEMBL4225224 0.93 AR (0.67) ARLMNAMAPTPGRNR3C1
SCHEMBL5028679 0.93 AR (0.67) ARLMNAMAPTPGRNR3C1

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-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

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 AR 7/4885LMNA 388/4885MAPT 4428/4885

“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.

Send feedback