SCHEMBL3759708

SCHEMBL3759708

C[C@]12C=CC(=O)C=C1CCC1C3CC[C@](OC(=O)c4ccc(Sc5ccccc5)cc4)(C(=O)SCCl)[C@@]3(C)C[C@H](O)C12F

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP3A4 P08684 6/20 0.50
▸ LMNA P02545 5/20 0.50
▸ HIF1A Q16665 5/20 0.50
▸ ALDH1A1 P00352 1/20 0.50
▸ NR3C1 P04150 7/20 0.49
▸ PGR P06401 4/20 0.49
▸ CYP2C9 P11712 3/20 0.49
▸ USP2 O75604 2/20 0.49
▸ NPSR1 Q6W5P4 2/20 0.49
▸ MLNR O43193 1/20 0.49
▸ NR1I2 O75469 1/20 0.49
▸ ABCB11 O95342 1/20 0.49
▸ MAPT P10636 1/20 0.49
▸ CYP3A5 P20815 1/20 0.49
▸ PPARG P37231 1/20 0.49
▸ SMN1; SMN2 Q16637 1/20 0.49
▸ CYP2D6 P10635 1/20 0.49
▸ HSD17B10 Q99714 2/20 0.46
▸ NFKB1 P19838 1/20 0.46
▸ CYP2J2 P51589 1/20 0.46

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
SCHEMBL3765710 1.00 CYP3A4 (0.50) CYP3A4LMNAHIF1AALDH1A1NR3C1
SCHEMBL3754453 0.94 CYP3A4 (0.51) CYP3A4LMNAHIF1AALDH1A1NR3C1
SCHEMBL3754454 0.94 CYP3A4 (0.51) CYP3A4LMNAHIF1AALDH1A1NR3C1
SCHEMBL13051217 0.93 CYP3A4 (0.50) CYP3A4LMNAHIF1AALDH1A1NR3C1
SCHEMBL2707624 0.91 NR3C1 (0.52) CYP3A4LMNAHIF1AALDH1A1NR3C1
SCHEMBL3765653 0.91 NR3C1 (0.52) CYP3A4LMNAHIF1AALDH1A1NR3C1
SCHEMBL3762018 0.91 CYP3A4 (0.48) CYP3A4LMNAHIF1AALDH1A1NR3C1
SCHEMBL3762015 0.91 CYP3A4 (0.48) CYP3A4LMNAHIF1AALDH1A1NR3C1
SCHEMBL12996701 0.91 CYP3A4 (0.51) CYP3A4LMNAHIF1AALDH1A1NR3C1
SCHEMBL3760132 0.88 NR3C1 (0.48) CYP3A4LMNAHIF1AALDH1A1NR3C1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100303758-A1 Novel Glucocorticoid Receptor Agonists GLOSSOP PAUL ALAN 2010-12-02 — — US claimed
US-20100303758-A1 Novel Glucocorticoid Receptor Agonists GLOSSOP PAUL ALAN 2010-12-02 — — 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-20100303758-A1 Novel Glucocorticoid Receptor Agonists NR3C1, NR3C2, MC2R CYP3A4 678/4885LMNA 4558/4885HIF1A 1893/4885

“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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