SCHEMBL6441599

SCHEMBL6441599

CCO[C@H]1C=C[C@@]2(C)[C@@H](CC[C@@H]3[C@@H]2CC[C@]2(C)[C@@H](OC(=O)Oc4ccccc4)CC[C@@H]32)C1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
SRD5A2 P31213 6/20 0.39
SRD5A1 P18405 6/20 0.39
HSD17B3 P37058 1/20 0.39
MAPT P10636 4/20 0.38
THRB P10828 1/20 0.38
CYP3A4 P08684 3/20 0.36
NR1I2 O75469 1/20 0.36
LMNA P02545 1/20 0.36
NR3C1 P04150 1/20 0.36
CYP17A1 P05093 1/20 0.36
PGR P06401 1/20 0.36
AR P10275 1/20 0.36
CYP2C9 P11712 1/20 0.36
TSHR P16473 1/20 0.36
CYP2C19 P33261 1/20 0.36
OPRK1 P41145 1/20 0.36
TP53 P04637 1/20 0.36
SMN1; SMN2 Q16637 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
SCHEMBL6443171 1.00 MEN1 (0.40) MEN1KMT2ASRD5A2SRD5A1HSD17B3
SCHEMBL6443353 0.91 MEN1 (0.39) MEN1KMT2ASRD5A2SRD5A1MAPT
SCHEMBL6447177 0.91 MEN1 (0.39) MEN1KMT2ASRD5A2SRD5A1MAPT
SCHEMBL6444908 0.87 MEN1 (0.40) MEN1KMT2ASRD5A2SRD5A1MAPT
SCHEMBL6446938 0.87 MEN1 (0.40) MEN1KMT2ASRD5A2SRD5A1MAPT
SCHEMBL6441605 0.87 CYP3A4 (0.39) MEN1KMT2AMAPTCYP3A4NR1I2
SCHEMBL6442641 0.87 CYP3A4 (0.39) MEN1KMT2AMAPTCYP3A4NR1I2
SCHEMBL6448565 0.87 CYP3A4 (0.39) MEN1KMT2ASRD5A2MAPTCYP3A4
SCHEMBL6441540 0.87 CYP3A4 (0.39) MEN1KMT2ASRD5A2MAPTCYP3A4
SCHEMBL6443061 0.85 MEN1 (0.38) MEN1KMT2AMAPTCYP3A4NR1I2

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 MEN1 2269/4885KMT2A 2320/4885SRD5A2 19/4885

“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.