SCHEMBL6446726

SCHEMBL6446726

COC(=O)O[C@H]1CC[C@H]2[C@@H]3CC[C@H]4C[C@@H](O)C=C[C@]4(C)[C@H]3CC[C@]12C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 3/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
HIF1A Q16665 1/20 0.40
VDR P11473 1/20 0.40
GPBAR1 Q8TDU6 1/20 0.40
CYP3A4 P08684 4/20 0.38
GABRP O00591 2/20 0.38
GABRD O14764 2/20 0.38
G6PD P11413 2/20 0.38
GABRA1 P14867 2/20 0.38
GABRB1 P18505 2/20 0.38
GABRG2 P18507 2/20 0.38
GABRB3 P28472 2/20 0.38
GABRA5 P31644 2/20 0.38
GABRA3 P34903 2/20 0.38
GABRA2 P47869 2/20 0.38
GABRB2 P47870 2/20 0.38
GABRA4 P48169 2/20 0.38
GABRE P78334 2/20 0.38

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
SCHEMBL6444178 1.00 CYP2C9 (0.40) CYP2C9MEN1KMT2AHIF1AVDR
SCHEMBL27663534 0.89 CYP19A1 (0.45) CYP2C9MEN1KMT2ACYP3A4GABRP
SCHEMBL6442680 0.89 CYP3A4 (0.40) CYP2C9MEN1KMT2ACYP3A4GABRP
SCHEMBL6446950 0.89 CYP3A4 (0.40) CYP2C9MEN1KMT2ACYP3A4GABRP
SCHEMBL6439906 0.89 CYP3A4 (0.40) CYP2C9MEN1KMT2ACYP3A4GABRP
SCHEMBL6442484 0.88 MEN1 (0.39) CYP2C9MEN1KMT2AHIF1AVDR
SCHEMBL6442230 0.88 MEN1 (0.39) CYP2C9MEN1KMT2AHIF1AVDR
SCHEMBL6444372 0.87 KMT2A (0.39) CYP2C9MEN1KMT2ACYP3A4GABRP
SCHEMBL6445468 0.87 KMT2A (0.39) CYP2C9MEN1KMT2ACYP3A4GABRP
SCHEMBL6444908 0.86 MEN1 (0.40) MEN1KMT2ACYP3A4G6PDMAPT

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-20050159366-A1 Pharmaceutical compositions and treatment methods - 8 BIOVIE INC. 2005-07-21 US claimed

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-20050159366-A1 Pharmaceutical compositions and treatment methods - 8 HSD17B7, NR5A1, HSD3B1 CYP2C9 468/4885MEN1 2269/4885KMT2A 2320/4885

“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.