SCHEMBL19639494

SCHEMBL19639494

CCOC(=O)n1nc(-c2ccc(OCOCCOC)c(C34CC5CC(CC(C5)C3)C4)c2)cc1-c1ccc(C(=O)OC)cc1

nearest known ligand 0.55

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
IKBKB O14920 4/20 0.55
RARA P10276 5/20 0.50
RARG P13631 9/20 0.40
RARB P10826 3/20 0.39
MEN1 O00255 1/20 0.39
NR1I2 O75469 1/20 0.39
LMNA P02545 1/20 0.39
PGR P06401 1/20 0.39
HSPD1 P10809 1/20 0.39
GOT1 P17174 1/20 0.39
GLRA1 P23415 1/20 0.39
BLM P54132 1/20 0.39
HSPE1 P61604 1/20 0.39
KMT2A Q03164 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
HDAC2 Q92769 1/20 0.36
HDAC11 Q96DB2 1/20 0.36
HIF1A Q16665 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
SCHEMBL17847397 0.91 IKBKB (0.59) IKBKBRARARARGRARBMEN1
SCHEMBL19639500 0.84 RARA (0.45) IKBKBRARARARGRARBMEN1
SCHEMBL19639516 0.81 IKBKB (0.60) IKBKBRARARARGRARBMEN1
SCHEMBL19639432 0.81 RARA (0.67) IKBKBRARARARGRARBMEN1
SCHEMBL19639470 0.80 IKBKB (0.59) IKBKBRARARARGRARBMEN1
SCHEMBL25230655 0.80 IKBKB (0.61) IKBKBRARARARGRARBMEN1
SCHEMBL30428692 0.80 IKBKB (0.61) IKBKBRARARARGRARBMEN1
SCHEMBL19639451 0.80 RARA (0.63) IKBKBRARARARGRARBMEN1
SCHEMBL19639489 0.79 RARA (0.62) IKBKBRARARARGRARBMEN1
SCHEMBL23927761 0.79 IKBKB (0.45) IKBKBRARARARGRARBMEN1

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
CN-107250115-B Compounds, synthesis method thereof and application thereof in medicines and cosmetics 盖尔德马研究及发展公司 2021-11-05 CN disclosed
US-10647688-B2 Compounds, synthesis method thereof and use of same in medicine and in cosmetics GALDERMA RESEARCH & DEVELOPMENT (FR) 2020-05-12 US disclosed
US-20170342040-A1 NOVEL COMPOUNDS, SYNTHESIS METHOD THEREOF AND USE OF SAME IN MEDICINE AND IN COSMETICS GALDERMA RESEARCH & DEVELOPMENT (FR) 2017-11-30 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 (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-20170342040-A1 NOVEL COMPOUNDS, SYNTHESIS METHOD THEREOF AND USE OF SAME IN MEDICINE AND IN COSMETICS RARA, RARB, RARG IKBKB 1870/4885RARA 1/4885RARG 3/4885
US-10647688-B2 Compounds, synthesis method thereof and use of same in medicine and in cosmetics RARA, RARB, RARG IKBKB 1544/4885RARA 1/4885RARG 3/4885

“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.